O5-ethyl O3-methyl 2-[(1-methanoylpyrrolidin-2-yl)methylsulfanyl]-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate

Systemtic Name: O5-ethyl O3-methyl 2-[(1-methanoylpyrrolidin-2-yl)methylsulfanyl]-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Openeye Name: O5-ethyl O3-methyl 2-[(1-formylpyrrolidin-2-yl)methylsulfanyl]-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate CAS Name: 2-[(1-formyl-2-pyrrolidinyl)methylthio]-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester IUPAC Name: 5-O-ethyl 3-O-methyl 2-[(1-formylpyrrolidin-2-yl)methylsulfanyl]-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylate Traditional Name: 2-[(1-formylpyrrolidin-2-yl)methylthio]-1,6-dimethyl-4-(3-nitrophenyl)-4H-pyridine-3,5-dicarboxylic acid O5-ethyl ester O3-methyl ester Formula: C24H29N3O7S MolecularWeight: 503.56796

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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)OC)SCC3CCCN3C=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C(C1C2=CC(=CC=C2)[N+](=O)[O-])C(=O)OC)SCC3CCCN3C=O)C)C

InChI

InChI=1S/C24H29N3O7S/c1-5-34-24(30)19-15(2)25(3)22(35-13-18-10-7-11-26(18)14-28)21(23(29)33-4)20(19)16-8-6-9-17(12-16)27(31)32/h6,8-9,12,14,18,20H,5,7,10-11,13H2,1-4H3