diethyl 2-methyl-4-(3-nitrophenyl)-6-(phenylsulfinylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: diethyl 2-methyl-4-(3-nitrophenyl)-6-(phenylsulfinylmethyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2-(benzenesulfinylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-(benzenesulfinylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(benzenesulfinylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-(benzenesulfinylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C25H26N2O7S MolecularWeight: 498.54814

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H26N2O7S/c1-4-33-24(28)21-16(3)26-20(15-35(32)19-12-7-6-8-13-19)23(25(29)34-5-2)22(21)17-10-9-11-18(14-17)27(30)31/h6-14,22,26H,4-5,15H2,1-3H3