O5-ethyl O3-methyl 2-methyl-4-(3-nitrophenyl)-6-[[(phenylmethyl)disulfanyl]methyl]-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-methyl 2-methyl-4-(3-nitrophenyl)-6-[[(phenylmethyl)disulfanyl]methyl]-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-methyl 2-[(benzyldisulfanyl)methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-methyl-4-(3-nitrophenyl)-6-[[(phenylmethyl)disulfanyl]methyl]-1,4-dihydropyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester IUPAC Name: 3-O-ethyl 5-O-methyl 2-[(benzyldisulfanyl)methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[(benzyldisulfanyl)methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester Formula: C25H26N2O6S2 MolecularWeight: 514.61374

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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)OC)C)CSSCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)C)CSSCC3=CC=CC=C3

InChI

InChI=1S/C25H26N2O6S2/c1-4-33-25(29)23-20(15-35-34-14-17-9-6-5-7-10-17)26-16(2)21(24(28)32-3)22(23)18-11-8-12-19(13-18)27(30)31/h5-13,22,26H,4,14-15H2,1-3H3