diethyl 1,2-dimethyl-4-(3-nitrophenyl)-6-(3,4,5-trimethoxyphenyl)carbonylsulfanyl-4H-pyridine-3,5-dicarboxylate

Systemtic Name: diethyl 1,2-dimethyl-4-(3-nitrophenyl)-6-(3,4,5-trimethoxyphenyl)carbonylsulfanyl-4H-pyridine-3,5-dicarboxylate Openeye Name: diethyl 1,2-dimethyl-4-(3-nitrophenyl)-6-(3,4,5-trimethoxybenzoyl)sulfanyl-4H-pyridine-3,5-dicarboxylate CAS Name: 1,2-dimethyl-4-(3-nitrophenyl)-6-[[oxo-(3,4,5-trimethoxyphenyl)methyl]thio]-4H-pyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 1,2-dimethyl-4-(3-nitrophenyl)-6-(3,4,5-trimethoxybenzoyl)sulfanyl-4H-pyridine-3,5-dicarboxylate Traditional Name: 1,2-dimethyl-4-(3-nitrophenyl)-6-[(3,4,5-trimethoxybenzoyl)thio]-4H-pyridine-3,5-dicarboxylic acid diethyl ester Formula: C29H32N2O10S MolecularWeight: 600.63678

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)SC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)SC(=O)C3=CC(=C(C(=C3)OC)OC)OC)C)C

InChI

InChI=1S/C29H32N2O10S/c1-8-40-27(32)22-16(3)30(4)26(42-29(34)18-14-20(37-5)25(39-7)21(15-18)38-6)24(28(33)41-9-2)23(22)17-11-10-12-19(13-17)31(35)36/h10-15,23H,8-9H2,1-7H3