CAS RN: 13051-12-2
CAS Name: 4-chloro-4-methyl-3-(4-nitrophenyl)-1H-pyrazol-5-one
OPENEYE Name: 4-chloro-4-methyl-3-(4-nitrophenyl)-1H-pyrazol-5-one
IUPAC Name: 4-chloro-4-methyl-3-(4-nitrophenyl)-1H-pyrazol-5-one
SYSTEMATIC NAME: 4-chloranyl-4-methyl-3-(4-nitrophenyl)-1H-pyrazol-5-one
MOLECULAR FORMULA: C10H8ClN3O3
MOLECULAR WEIGHT: 253.64182
SMILES: CC1(C(=NNC1=O)C2=CC=C(C=C2)[N+](=O)[O-])Cl
Structure:
CAS RN: 41420-90-0
CAS Name: N-(5,6-dichloro-1H-benzimidazol-2-yl)carbamic acid methyl ester
OPENEYE Name: methyl N-(5,6-dichloro-1H-benzimidazol-2-yl)carbamate
IUPAC Name: methyl N-(5,6-dichloro-1H-benzimidazol-2-yl)carbamate
SYSTEMATIC NAME: methyl N-[5,6-bis(chloranyl)-1H-benzimidazol-2-yl]carbamate
MOLECULAR FORMULA: C9H7Cl2N3O2
MOLECULAR WEIGHT: 260.07678
SMILES: COC(=O)NC1=NC2=CC(=C(C=C2N1)Cl)Cl
Structure:
CAS RN: 19358-00-0
CAS Name: N-[5,6-diamino-4-(4-chloroanilino)-2-pyridinyl]carbamic acid ethyl ester
OPENEYE Name: ethyl N-[5,6-diamino-4-(4-chloroanilino)-2-pyridyl]carbamate
IUPAC Name: ethyl N-[5,6-diamino-4-(4-chloroanilino)pyridin-2-yl]carbamate
SYSTEMATIC NAME: ethyl N-[5,6-bis(azanyl)-4-[(4-chlorophenyl)amino]pyridin-2-yl]carbamate
MOLECULAR FORMULA: C14H16ClN5O2
MOLECULAR WEIGHT: 321.76214
SMILES: CCOC(=O)NC1=NC(=C(C(=C1)NC2=CC=C(C=C2)Cl)N)N
Structure:
CAS RN: 32418-97-6
CAS Name: 4-amino-4-dithiolanecarboxylic acid
OPENEYE Name: 4-aminodithiolane-4-carboxylic acid
IUPAC Name: 4-aminodithiolane-4-carboxylic acid
SYSTEMATIC NAME: 4-azanyl-1,2-dithiolane-4-carboxylic acid
MOLECULAR FORMULA: C4H7NO2S2
MOLECULAR WEIGHT: 165.23388
SMILES: C1C(CSS1)(C(=O)O)N
Structure:
CAS RN: 4764-79-8
CAS Name: 2-(1-methyl-2-oxo-4-quinolinyl)acetic acid
OPENEYE Name: 2-(1-methyl-2-oxo-4-quinolyl)acetic acid
IUPAC Name: 2-(1-methyl-2-oxoquinolin-4-yl)acetic acid
SYSTEMATIC NAME: 2-(1-methyl-2-oxidanylidene-quinolin-4-yl)ethanoic acid
MOLECULAR FORMULA: C12H11NO3
MOLECULAR WEIGHT: 217.22064
SMILES: CN1C2=CC=CC=C2C(=CC1=O)CC(=O)O
Structure:
CAS RN: 4764-81-2
CAS Name: 2-(1-methyl-2-oxo-4-quinolinyl)acetic acid ethyl ester
OPENEYE Name: ethyl 2-(1-methyl-2-oxo-4-quinolyl)acetate
IUPAC Name: ethyl 2-(1-methyl-2-oxoquinolin-4-yl)acetate
SYSTEMATIC NAME: ethyl 2-(1-methyl-2-oxidanylidene-quinolin-4-yl)ethanoate
MOLECULAR FORMULA: C14H15NO3
MOLECULAR WEIGHT: 245.2738
SMILES: CCOC(=O)CC1=CC(=O)N(C2=CC=CC=C21)C
Structure:
CAS RN: 20389-09-7
CAS Name: 2-(2-chlorophenyl)-4-quinolinecarboxylic acid
OPENEYE Name: 2-(2-chlorophenyl)quinoline-4-carboxylic acid
IUPAC Name: 2-(2-chlorophenyl)quinoline-4-carboxylic acid
SYSTEMATIC NAME: 2-(2-chlorophenyl)quinoline-4-carboxylic acid
MOLECULAR FORMULA: C16H10ClNO2
MOLECULAR WEIGHT: 283.7091
SMILES: C1=CC=C2C(=C1)C(=CC(=N2)C3=CC=CC=C3Cl)C(=O)O
Structure:
CAS RN: 3913-17-5
CAS Name: 2-chloro-4,8-dimethylquinoline
OPENEYE Name: 2-chloro-4,8-dimethyl-quinoline
IUPAC Name: 2-chloro-4,8-dimethylquinoline
SYSTEMATIC NAME: 2-chloranyl-4,8-dimethyl-quinoline
MOLECULAR FORMULA: C11H10ClN
MOLECULAR WEIGHT: 191.6568
SMILES: CC1=CC=CC2=C1N=C(C=C2C)Cl
Structure:
CAS RN: 3950-28-5
CAS Name: 2-chloro-4,8-dimethylquinoline
OPENEYE Name: 2-chloro-4,8-dimethyl-quinoline
IUPAC Name: 2-chloro-4,8-dimethylquinoline
SYSTEMATIC NAME: 2-chloranyl-4,8-dimethyl-quinoline
MOLECULAR FORMULA: C11H10ClN
MOLECULAR WEIGHT: 191.6568
SMILES: CC1=CC=CC2=C1N=C(C=C2C)Cl
Structure:
CAS RN: 28742-49-6
CAS Name: 3-methoxy-11,12,13,14,15,17-hexahydrocyclopenta[a]phenanthren-16-one
OPENEYE Name: 3-methoxy-11,12,13,14,15,17-hexahydrocyclopenta[a]phenanthren-16-one
IUPAC Name: 3-methoxy-11,12,13,14,15,17-hexahydrocyclopenta[a]phenanthren-16-one
SYSTEMATIC NAME: 3-methoxy-11,12,13,14,15,17-hexahydrocyclopenta[a]phenanthren-16-one
MOLECULAR FORMULA: C18H18O2
MOLECULAR WEIGHT: 266.33432
SMILES: COC1=CC2=C(C=C1)C3=C(C=C2)C4CC(=O)CC4CC3
Structure:
CAS RN: 9011-07-8
CAS Name: acetic acid ethenyl ester; furan-2,5-dione
OPENEYE Name: furan-2,5-dione; vinyl acetate
IUPAC Name: ethenyl acetate; furan-2,5-dione
SYSTEMATIC NAME: ethenyl ethanoate; furan-2,5-dione
MOLECULAR FORMULA: C8H8O5
MOLECULAR WEIGHT: 184.14612
SMILES: CC(=O)OC=C.C1=CC(=O)OC1=O
Structure:
CAS RN: 100114-41-8
CAS Name: acetic acid ethenyl ester; furan-2,5-dione
OPENEYE Name: furan-2,5-dione; vinyl acetate
IUPAC Name: ethenyl acetate; furan-2,5-dione
SYSTEMATIC NAME: ethenyl ethanoate; furan-2,5-dione
MOLECULAR FORMULA: C8H8O5
MOLECULAR WEIGHT: 184.14612
SMILES: CC(=O)OC=C.C1=CC(=O)OC1=O
Structure:
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