ethyl 5-[(4-chloranyl-3-nitro-phenyl)-(5-ethoxycarbonyl-2-oxidanyl-4-oxidanylidene-6-pyrrolidin-2-yl-1H-pyridin-3-yl)methyl]-6-oxidanyl-4-oxidanylidene-2-pyrrolidin-2-yl-1H-pyridine-3-carboxylate

Systemtic Name: ethyl 5-[(4-chloranyl-3-nitro-phenyl)-(5-ethoxycarbonyl-2-oxidanyl-4-oxidanylidene-6-pyrrolidin-2-yl-1H-pyridin-3-yl)methyl]-6-oxidanyl-4-oxidanylidene-2-pyrrolidin-2-yl-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-[(4-chloro-3-nitro-phenyl)-(5-ethoxycarbonyl-2-hydroxy-4-oxo-6-pyrrolidin-2-yl-1H-pyridin-3-yl)methyl]-6-hydroxy-4-oxo-2-pyrrolidin-2-yl-1H-pyridine-3-carboxylate CAS Name: 5-[(4-chloro-3-nitrophenyl)-[5-ethoxycarbonyl-2-hydroxy-4-oxo-6-(2-pyrrolidinyl)-1H-pyridin-3-yl]methyl]-6-hydroxy-4-oxo-2-(2-pyrrolidinyl)-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-chloro-3-nitrophenyl)-(5-ethoxycarbonyl-2-hydroxy-4-oxo-6-pyrrolidin-2-yl-1H-pyridin-3-yl)methyl]-6-hydroxy-4-oxo-2-pyrrolidin-2-yl-1H-pyridine-3-carboxylate Traditional Name: 5-[(5-carbethoxy-2-hydroxy-4-keto-6-pyrrolidin-2-yl-1H-pyridin-3-yl)-(4-chloro-3-nitro-phenyl)methyl]-6-hydroxy-4-keto-2-pyrrolidin-2-yl-1H-pyridine-3-carboxylic acid ethyl ester Formula: C31H34ClN5O10 MolecularWeight: 672.08216

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C(C1=O)C(C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=C(NC(=C(C3=O)C(=O)OCC)C4CCCN4)O)O)C5CCCN5

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1=O)C(C2=CC(=C(C=C2)Cl)[N+](=O)[O-])C3=C(NC(=C(C3=O)C(=O)OCC)C4CCCN4)O)O)C5CCCN5

InChI

InChI=1S/C31H34ClN5O10/c1-3-46-30(42)22-24(16-7-5-11-33-16)35-28(40)20(26(22)38)19(14-9-10-15(32)18(13-14)37(44)45)21-27(39)23(31(43)47-4-2)25(36-29(21)41)17-8-6-12-34-17/h9-10,13,16-17,19,33-34H,3-8,11-12H2,1-2H3,(H2,35,38,40)(H2,36,39,41)