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

Systemtic Name: diethyl 2-(imidazol-1-ylcarbonyloxymethylsulfanylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: diethyl 2-(imidazole-1-carbonyloxymethylsulfanylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[[[1-imidazolyl(oxo)methoxy]methylthio]methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester IUPAC Name: diethyl 2-(imidazole-1-carbonyloxymethylsulfanylmethyl)-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[(imidazole-1-carbonyloxymethylthio)methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid diethyl ester Formula: C24H26N4O8S MolecularWeight: 530.55024

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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)CSCOC(=O)N3C=CN=C3)C

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OCC)CSCOC(=O)N3C=CN=C3)C

InChI

InChI=1S/C24H26N4O8S/c1-4-34-22(29)19-15(3)26-18(12-37-14-36-24(31)27-10-9-25-13-27)21(23(30)35-5-2)20(19)16-7-6-8-17(11-16)28(32)33/h6-11,13,20,26H,4-5,12,14H2,1-3H3