2-ethylsulfanylethyl 7-(3,4-dimethoxyphenyl)-2-methyl-4-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate

Systemtic Name: 2-ethylsulfanylethyl 7-(3,4-dimethoxyphenyl)-2-methyl-4-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Openeye Name: 2-ethylsulfanylethyl 7-(3,4-dimethoxyphenyl)-2-methyl-4-(4-methyl-3-nitro-phenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate CAS Name: 7-(3,4-dimethoxyphenyl)-2-methyl-4-(4-methyl-3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester IUPAC Name: 2-ethylsulfanylethyl 7-(3,4-dimethoxyphenyl)-2-methyl-4-(4-methyl-3-nitrophenyl)-5-oxo-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylate Traditional Name: 7-(3,4-dimethoxyphenyl)-5-keto-2-methyl-4-(4-methyl-3-nitro-phenyl)-4,6,7,8-tetrahydro-1H-quinoline-3-carboxylic acid 2-(ethylthio)ethyl ester Formula: C30H34N2O7S MolecularWeight: 566.66516

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Descriptors Computed from Structure

Canonical SMILES:

CCSCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)C)[N+](=O)[O-])C(=O)CC(C2)C4=CC(=C(C=C4)OC)OC)C

Isomeric SMILES

CCSCCOC(=O)C1=C(NC2=C(C1C3=CC(=C(C=C3)C)[N+](=O)[O-])C(=O)CC(C2)C4=CC(=C(C=C4)OC)OC)C

InChI

InChI=1S/C30H34N2O7S/c1-6-40-12-11-39-30(34)27-18(3)31-22-13-21(19-9-10-25(37-4)26(16-19)38-5)15-24(33)29(22)28(27)20-8-7-17(2)23(14-20)32(35)36/h7-10,14,16,21,28,31H,6,11-13,15H2,1-5H3