O3-ethyl O5-methyl 2-[(2-azanyl-3-ethoxy-3-oxidanylidene-propyl)sulfanylmethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate

Systemtic Name: O3-ethyl O5-methyl 2-[(2-azanyl-3-ethoxy-3-oxidanylidene-propyl)sulfanylmethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Openeye Name: O3-ethyl O5-methyl 2-[(2-amino-3-ethoxy-3-oxo-propyl)sulfanylmethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate CAS Name: 2-[[(2-amino-3-ethoxy-3-oxopropyl)thio]methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester IUPAC Name: 3-O-ethyl 5-O-methyl 2-[(2-amino-3-ethoxy-3-oxopropyl)sulfanylmethyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate Traditional Name: 2-[[(2-amino-3-ethoxy-3-keto-propyl)thio]methyl]-6-methyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylic acid O3-ethyl ester O5-methyl ester Formula: C23H29N3O8S MolecularWeight: 507.55666

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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)CSCC(C(=O)OCC)N

Isomeric SMILES

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

InChI

InChI=1S/C23H29N3O8S/c1-5-33-21(27)16(24)11-35-12-17-20(23(29)34-6-2)19(18(13(3)25-17)22(28)32-4)14-8-7-9-15(10-14)26(30)31/h7-10,16,19,25H,5-6,11-12,24H2,1-4H3