smiles
stringlengths 2
322
| selfies
stringlengths 6
952
| target
class label 2
classes |
|---|---|---|
CCC(=O)OC/C=C/c1ccccc1
|
[C][C][C][=Branch1][C][=O][O][C][/C][=C][/C][=C][C][=C][C][=C][Ring1][=Branch1]
| 00
|
CCCC(=O)OCCc1ccccc1
|
[C][C][C][C][=Branch1][C][=O][O][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
| 00
|
CC(C)C(=O)OCC=Cc1ccccc1
|
[C][C][Branch1][C][C][C][=Branch1][C][=O][O][C][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1]
| 00
|
Nc1ccc([As](=O)([O-])O)cc1
|
[N][C][=C][C][=C][Branch1][=Branch2][As][=Branch1][C][=O][Branch1][C][O-1][O][C][=C][Ring1][#Branch2]
| 00
|
CCCCCCCc1ccc(O)cc1
|
[C][C][C][C][C][C][C][C][=C][C][=C][Branch1][C][O][C][=C][Ring1][#Branch1]
| 00
|
Cc1cccc([N+](=O)[O-])c1C(=O)O
|
[C][C][=C][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][=Branch2][C][=Branch1][C][=O][O]
| 00
|
CC(=O)Nc1c(I)c(NC(C)=O)c(I)c(C(=O)[O-])c1I
|
[C][C][=Branch1][C][=O][N][C][=C][Branch1][C][I][C][Branch1][#Branch1][N][C][Branch1][C][C][=O][=C][Branch1][C][I][C][Branch1][=Branch1][C][=Branch1][C][=O][O-1][=C][Ring1][#C][I]
| 00
|
Cc1ccc(N)cc1[N+](=O)[O-]
|
[C][C][=C][C][=C][Branch1][C][N][C][=C][Ring1][#Branch1][N+1][=Branch1][C][=O][O-1]
| 00
|
Cc1c(C(=O)O)cccc1[N+](=O)[O-]
|
[C][C][=C][Branch1][=Branch1][C][=Branch1][C][=O][O][C][=C][C][=C][Ring1][=Branch2][N+1][=Branch1][C][=O][O-1]
| 00
|
CCCN(CCC)c1c([N+](=O)[O-])cc(S(C)(=O)=O)cc1[N+](=O)[O-]
|
[C][C][C][N][Branch1][Ring2][C][C][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Branch1][=Branch2][S][Branch1][C][C][=Branch1][C][=O][=O][C][=C][Ring1][=N][N+1][=Branch1][C][=O][O-1]
| 00
|
CC(Oc1cccc(Cl)c1)C(=O)O
|
[C][C][Branch1][=N][O][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1][C][=Branch1][C][=O][O]
| 00
|
O=Cc1ccc(F)c(Br)c1
|
[O][=C][C][=C][C][=C][Branch1][C][F][C][Branch1][C][Br][=C][Ring1][Branch2]
| 00
|
O=C(O)c1ccccc1S
|
[O][=C][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][S]
| 00
|
OCC(O)COc1ccc(Cl)cc1
|
[O][C][C][Branch1][C][O][C][O][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
| 00
|
O=P(O)(O)Oc1ccccc1
|
[O][=P][Branch1][C][O][Branch1][C][O][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
| 00
|
CCC(=O)c1c(O)cc(O)cc1O
|
[C][C][C][=Branch1][C][=O][C][=C][Branch1][C][O][C][=C][Branch1][C][O][C][=C][Ring1][Branch2][O]
| 00
|
O=[N+]([O-])c1ccccc1O
|
[O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][=C][Ring1][=Branch1][O]
| 00
|
Cc1ccccc1N=O
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][=O]
| 00
|
CCCCCCOc1cc(C)c(O)c(C)c1C
|
[C][C][C][C][C][C][O][C][=C][C][Branch1][C][C][=C][Branch1][C][O][C][Branch1][C][C][=C][Ring1][=Branch2][C]
| 00
|
CCc1cccc(CC)c1N(COC)C(=O)CCl
|
[C][C][C][=C][C][=C][C][Branch1][Ring1][C][C][=C][Ring1][Branch2][N][Branch1][Ring2][C][O][C][C][=Branch1][C][=O][C][Cl]
| 00
|
Cc1ccc([N+](=O)[O-])cc1
|
[C][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2]
| 00
|
O=C(CCCCCCC(=O)Nc1ccccc1)NO
|
[O][=C][Branch2][Ring1][Ring2][C][C][C][C][C][C][C][=Branch1][C][=O][N][C][=C][C][=C][C][=C][Ring1][=Branch1][N][O]
| 11
|
C[C@H](N)[C@H](O)c1cccc(O)c1
|
[C][C@H1][Branch1][C][N][C@H1][Branch1][C][O][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1]
| 00
|
Clc1ccc(C(Cl)(Cl)Cl)c(Cl)c1
|
[Cl][C][=C][C][=C][Branch1][=Branch2][C][Branch1][C][Cl][Branch1][C][Cl][Cl][C][Branch1][C][Cl][=C][Ring1][O]
| 00
|
CCCCNc1ccc(C(=O)OCCN(C)C)cc1
|
[C][C][C][C][N][C][=C][C][=C][Branch1][=N][C][=Branch1][C][=O][O][C][C][N][Branch1][C][C][C][C][=C][Ring1][=C]
| 00
|
CNC(=O)Oc1c(C(C)(C)C)cc(C)cc1C(C)(C)C
|
[C][N][C][=Branch1][C][=O][O][C][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Branch1][C][C][C][=C][Ring1][O][C][Branch1][C][C][Branch1][C][C][C]
| 00
|
CCC(C)(CN(C)C)OC(=O)c1ccccc1
|
[C][C][C][Branch1][C][C][Branch1][#Branch1][C][N][Branch1][C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1]
| 00
|
CCCOc1cc(N)ccc1C(=O)OCCN(CC)CC
|
[C][C][C][O][C][=C][C][Branch1][C][N][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C][C][N][Branch1][Ring1][C][C][C][C]
| 00
|
O=[N+]([O-])c1ccccc1[O-]
|
[O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][=C][Ring1][=Branch1][O-1]
| 00
|
NCC(O)c1cccc(O)c1
|
[N][C][C][Branch1][C][O][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1]
| 00
|
Oc1cc(Cl)c(Cl)c(Cl)c1
|
[O][C][=C][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][=Branch2]
| 00
|
Cc1ccccc1NC(=N)NC(=N)N
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][N][C][=Branch1][C][=N][N][C][=Branch1][C][=N][N]
| 00
|
CCOP(=O)(OCC)Oc1ccc([N+](=O)[O-])cc1
|
[C][C][O][P][=Branch1][C][=O][Branch1][Ring2][O][C][C][O][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2]
| 00
|
Cc1ccc(NC=O)c(C)c1
|
[C][C][=C][C][=C][Branch1][Ring2][N][C][=O][C][Branch1][C][C][=C][Ring1][#Branch2]
| 00
|
COc1ccc(CCC(C)=O)cc1
|
[C][O][C][=C][C][=C][Branch1][Branch2][C][C][C][Branch1][C][C][=O][C][=C][Ring1][O]
| 00
|
CCN(CC)CC(=O)Nc1c(C)cccc1C(=O)OC
|
[C][C][N][Branch1][Ring1][C][C][C][C][=Branch1][C][=O][N][C][=C][Branch1][C][C][C][=C][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O][C]
| 00
|
CC(=O)N(CC(=O)N(C)C)c1ccccc1
|
[C][C][=Branch1][C][=O][N][Branch1][O][C][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][C][=C][C][=C][Ring1][=Branch1]
| 00
|
O=C(CCCCl)c1ccc(F)cc1
|
[O][=C][Branch1][Branch1][C][C][C][Cl][C][=C][C][=C][Branch1][C][F][C][=C][Ring1][#Branch1]
| 00
|
O=Cc1ccc(Cl)c([N+](=O)[O-])c1
|
[O][=C][C][=C][C][=C][Branch1][C][Cl][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][#Branch2]
| 00
|
COC(=O)c1cc(Cl)ccc1NS(=O)(=O)C(F)(F)F
|
[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][N][S][=Branch1][C][=O][=Branch1][C][=O][C][Branch1][C][F][Branch1][C][F][F]
| 00
|
O=[N+]([O-])c1cccc(C(F)(F)F)c1
|
[O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2]
| 00
|
Cc1ccccc1[N+](=O)[O-]
|
[C][C][=C][C][=C][C][=C][Ring1][=Branch1][N+1][=Branch1][C][=O][O-1]
| 00
|
O=[N+]([O-])c1ccccc1C(F)(F)F
|
[O][=N+1][Branch1][C][O-1][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][F][Branch1][C][F][F]
| 00
|
CCc1cc(C(C)(C)C)c(O)c(C(C)(C)C)c1
|
[C][C][C][=C][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Branch1][C][O][C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][=C][Ring1][#C]
| 00
|
COc1cc(NC(=O)CC(C)=O)c(OC)cc1Cl
|
[C][O][C][=C][C][Branch1][N][N][C][=Branch1][C][=O][C][C][Branch1][C][C][=O][=C][Branch1][Ring1][O][C][C][=C][Ring1][#C][Cl]
| 00
|
Oc1c(Br)c(Br)c(Br)c(Br)c1Br
|
[O][C][=C][Branch1][C][Br][C][Branch1][C][Br][=C][Branch1][C][Br][C][Branch1][C][Br][=C][Ring1][#Branch2][Br]
| 00
|
NC(Cc1ccc(Cl)cc1)C(=O)O
|
[N][C][Branch1][=N][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1][C][=Branch1][C][=O][O]
| 00
|
Nc1cc([N+](=O)[O-])ccc1O
|
[N][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][=C][Ring1][=Branch2][O]
| 00
|
Nc1ccc([N+](=O)[O-])cc1O
|
[N][C][=C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][=Branch2][O]
| 00
|
Nc1ccc(O)c([N+](=O)[O-])c1
|
[N][C][=C][C][=C][Branch1][C][O][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][#Branch2]
| 00
|
CC(=O)OCC(=O)Nc1cc(C#N)cc(NC(=O)COC(C)=O)c1Cl
|
[C][C][=Branch1][C][=O][O][C][C][=Branch1][C][=O][N][C][=C][C][Branch1][Ring1][C][#N][=C][C][Branch1][=N][N][C][=Branch1][C][=O][C][O][C][Branch1][C][C][=O][=C][Ring1][S][Cl]
| 00
|
Cc1ccc(O)c(O)c1
|
[C][C][=C][C][=C][Branch1][C][O][C][Branch1][C][O][=C][Ring1][Branch2]
| 00
|
FC(F)(F)c1ccc(Cl)c(Cl)c1
|
[F][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2]
| 00
|
O=C=Nc1cccc(C(F)(F)F)c1
|
[O][=C][=N][C][=C][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][Ring1][#Branch2]
| 00
|
Nc1ccc(Cl)c(Cl)c1
|
[N][C][=C][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][Branch2]
| 00
|
Nc1ccccc1Cl
|
[N][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
| 00
|
FC(F)(F)c1ccc(Cl)cc1
|
[F][C][Branch1][C][F][Branch1][C][F][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
| 00
|
C=Cc1ccc(C=C)cc1
|
[C][=C][C][=C][C][=C][Branch1][Ring1][C][=C][C][=C][Ring1][Branch2]
| 00
|
Nc1ccc([As](=O)(O)O)cc1
|
[N][C][=C][C][=C][Branch1][=Branch2][As][=Branch1][C][=O][Branch1][C][O][O][C][=C][Ring1][#Branch2]
| 00
|
COC(=O)c1cc(C(=O)OC)cc(S(=O)(=O)[O-])c1
|
[C][O][C][=Branch1][C][=O][C][=C][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=C][C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O-1][=C][Ring1][=C]
| 00
|
CC(C)(C)c1cc(O)c(C(C)(C)C)cc1O
|
[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][Branch1][C][O][=C][Branch1][=Branch2][C][Branch1][C][C][Branch1][C][C][C][C][=C][Ring1][O][O]
| 00
|
CC(C)CCCCOC(=O)c1ccccc1C(=O)OCCCCC(C)C
|
[C][C][Branch1][C][C][C][C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][C][C][C][Branch1][C][C][C]
| 00
|
CC(C)(C)C(=O)CCc1ccc(Cl)cc1
|
[C][C][Branch1][C][C][Branch1][C][C][C][=Branch1][C][=O][C][C][C][=C][C][=C][Branch1][C][Cl][C][=C][Ring1][#Branch1]
| 00
|
Cc1cc(C)cc(C)c1
|
[C][C][=C][C][Branch1][C][C][=C][C][Branch1][C][C][=C][Ring1][Branch2]
| 00
|
Cc1cccc(N)c1
|
[C][C][=C][C][=C][C][Branch1][C][N][=C][Ring1][#Branch1]
| 00
|
CC(C)Cc1ccc(CC(=O)O)cc1
|
[C][C][Branch1][C][C][C][C][=C][C][=C][Branch1][#Branch1][C][C][=Branch1][C][=O][O][C][=C][Ring1][#Branch2]
| 00
|
C=CC(C)(CCC=C(C)C)OC(=O)C=Cc1ccccc1
|
[C][=C][C][Branch1][C][C][Branch1][=Branch2][C][C][C][=C][Branch1][C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1]
| 00
|
C/C=C/C(=O)Oc1c(CCCCCC(C)C)cc([N+](=O)[O-])cc1[N+](=O)[O-]
|
[C][/C][=C][/C][=Branch1][C][=O][O][C][=C][Branch1][O][C][C][C][C][C][C][Branch1][C][C][C][C][=C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][C][=C][Ring1][P][N+1][=Branch1][C][=O][O-1]
| 00
|
OCCSc1ccccc1
|
[O][C][C][S][C][=C][C][=C][C][=C][Ring1][=Branch1]
| 00
|
CSc1c(Cl)c(Cl)c(Cl)c(Cl)c1Cl
|
[C][S][C][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Branch1][C][Cl][C][Branch1][C][Cl][=C][Ring1][#Branch2][Cl]
| 00
|
COC(=O)c1ccccc1OC
|
[C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C]
| 00
|
CCc1ccc(C=O)cc1
|
[C][C][C][=C][C][=C][Branch1][Ring1][C][=O][C][=C][Ring1][Branch2]
| 00
|
CCOP(=S)(OCC)SCSc1cc(Cl)ccc1Cl
|
[C][C][O][P][=Branch1][C][=S][Branch1][Ring2][O][C][C][S][C][S][C][=C][C][Branch1][C][Cl][=C][C][=C][Ring1][#Branch1][Cl]
| 00
|
COCCCOc1cc(C[C@@H](C[C@H](N)[C@@H](O)C[C@H](C(=O)NCC(C)(C)C(N)=O)C(C)C)C(C)C)ccc1OC
|
[C][O][C][C][C][O][C][=C][C][Branch2][Ring2][S][C][C@@H1][Branch2][Ring2][=Branch1][C][C@H1][Branch1][C][N][C@@H1][Branch1][C][O][C][C@H1][Branch2][Ring1][Ring1][C][=Branch1][C][=O][N][C][C][Branch1][C][C][Branch1][C][C][C][Branch1][C][N][=O][C][Branch1][C][C][C][C][Branch1][C][C][C][=C][C][=C][Ring2][Ring1][#C][O][C]
| 00
|
Cc1c(N)cccc1N
|
[C][C][=C][Branch1][C][N][C][=C][C][=C][Ring1][#Branch1][N]
| 00
|
O=S(=O)(O)c1ccccc1
|
[O][=S][=Branch1][C][=O][Branch1][C][O][C][=C][C][=C][C][=C][Ring1][=Branch1]
| 00
|
NCCc1cc(O)c(O)cc1O
|
[N][C][C][C][=C][C][Branch1][C][O][=C][Branch1][C][O][C][=C][Ring1][Branch2][O]
| 00
|
NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1
|
[N][C][=Branch1][C][=O][C][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][C][Branch1][=Branch1][N+1][=Branch1][C][=O][O-1][=C][Ring1][N]
| 00
|
CCCCCCCCCCCOC(=O)c1ccccc1C(=O)OCCCCCCCCCCC
|
[C][C][C][C][C][C][C][C][C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][C][C][C][C][C][C][C][C][C]
| 00
|
C=Cc1ccccc1C=C
|
[C][=C][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=C]
| 00
|
CCCCCCCCCC(CC)c1ccc(S(=O)(=O)[O-])cc1
|
[C][C][C][C][C][C][C][C][C][C][Branch1][Ring1][C][C][C][=C][C][=C][Branch1][=Branch2][S][=Branch1][C][=O][=Branch1][C][=O][O-1][C][=C][Ring1][#Branch2]
| 00
|
COc1ccccc1OCC(O)CO
|
[C][O][C][=C][C][=C][C][=C][Ring1][=Branch1][O][C][C][Branch1][C][O][C][O]
| 00
|
CCCCCc1cc(O)cc(O)c1
|
[C][C][C][C][C][C][=C][C][Branch1][C][O][=C][C][Branch1][C][O][=C][Ring1][Branch2]
| 00
|
CN(C)Cc1cc(CN(C)C)c(O)c(CN(C)C)c1
|
[C][N][Branch1][C][C][C][C][=C][C][Branch1][#Branch1][C][N][Branch1][C][C][C][=C][Branch1][C][O][C][Branch1][#Branch1][C][N][Branch1][C][C][C][=C][Ring1][#C]
| 00
|
CCCCCOC(=O)c1ccccc1C(=O)OCCCCC
|
[C][C][C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][C][C][C]
| 00
|
CCCOC(=O)c1ccccc1C(=O)OCCC
|
[C][C][C][O][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][=Branch1][C][=O][O][C][C][C]
| 00
|
CCOC(=O)c1ccc(I)cc1
|
[C][C][O][C][=Branch1][C][=O][C][=C][C][=C][Branch1][C][I][C][=C][Ring1][#Branch1]
| 00
|
CN(C)c1ccc(CCO)cc1
|
[C][N][Branch1][C][C][C][=C][C][=C][Branch1][Ring2][C][C][O][C][=C][Ring1][=Branch2]
| 00
|
CNC(=O)Oc1ccccc1C(C)C
|
[C][N][C][=Branch1][C][=O][O][C][=C][C][=C][C][=C][Ring1][=Branch1][C][Branch1][C][C][C]
| 00
|
CC(C)c1ccc(NC(=O)N(C)C)cc1
|
[C][C][Branch1][C][C][C][=C][C][=C][Branch1][O][N][C][=Branch1][C][=O][N][Branch1][C][C][C][C][=C][Ring1][N]
| 00
|
Cc1ccc(C(C)C)cc1O
|
[C][C][=C][C][=C][Branch1][=Branch1][C][Branch1][C][C][C][C][=C][Ring1][=Branch2][O]
| 00
|
CC(=O)Nc1ccc(C)cc1
|
[C][C][=Branch1][C][=O][N][C][=C][C][=C][Branch1][C][C][C][=C][Ring1][#Branch1]
| 00
|
CCC(=O)C=Cc1ccc(OC)cc1
|
[C][C][C][=Branch1][C][=O][C][=C][C][=C][C][=C][Branch1][Ring1][O][C][C][=C][Ring1][Branch2]
| 00
|
O=[N+]([O-])c1cc(C(F)(F)F)ccc1Cl
|
[O][=N+1][Branch1][C][O-1][C][=C][C][Branch1][=Branch2][C][Branch1][C][F][Branch1][C][F][F][=C][C][=C][Ring1][#Branch2][Cl]
| 00
|
COc1cc(Cl)c(OC)cc1Cl
|
[C][O][C][=C][C][Branch1][C][Cl][=C][Branch1][Ring1][O][C][C][=C][Ring1][=Branch2][Cl]
| 00
|
CC(C)CC=C(C=O)c1ccccc1
|
[C][C][Branch1][C][C][C][C][=C][Branch1][Ring1][C][=O][C][=C][C][=C][C][=C][Ring1][=Branch1]
| 00
|
Sc1ccccc1Cl
|
[S][C][=C][C][=C][C][=C][Ring1][=Branch1][Cl]
| 00
|
CCS(=O)(=O)c1ccc(OC)c(C(=O)OC)c1
|
[C][C][S][=Branch1][C][=O][=Branch1][C][=O][C][=C][C][=C][Branch1][Ring1][O][C][C][Branch1][#Branch1][C][=Branch1][C][=O][O][C][=C][Ring1][N]
| 00
|
ClCc1cccc(Cl)c1
|
[Cl][C][C][=C][C][=C][C][Branch1][C][Cl][=C][Ring1][#Branch1]
| 00
|
CC(C)(C)c1cccc(O)c1
|
[C][C][Branch1][C][C][Branch1][C][C][C][=C][C][=C][C][Branch1][C][O][=C][Ring1][#Branch1]
| 00
|
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