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

Systemtic Name: ethyl 5-[(4-chloranyl-2-nitro-phenyl)-(5-ethoxycarbonyl-2-oxidanyl-4-oxidanylidene-6-pyrrolidin-1-yl-1H-pyridin-3-yl)methyl]-6-oxidanyl-4-oxidanylidene-2-pyrrolidin-1-yl-1H-pyridine-3-carboxylate Openeye Name: ethyl 5-[(4-chloro-2-nitro-phenyl)-(5-ethoxycarbonyl-2-hydroxy-4-oxo-6-pyrrolidin-1-yl-1H-pyridin-3-yl)methyl]-6-hydroxy-4-oxo-2-pyrrolidin-1-yl-1H-pyridine-3-carboxylate CAS Name: 5-[(4-chloro-2-nitrophenyl)-[5-ethoxycarbonyl-2-hydroxy-4-oxo-6-(1-pyrrolidinyl)-1H-pyridin-3-yl]methyl]-6-hydroxy-4-oxo-2-(1-pyrrolidinyl)-1H-pyridine-3-carboxylic acid ethyl ester IUPAC Name: ethyl 5-[(4-chloro-2-nitrophenyl)-(5-ethoxycarbonyl-2-hydroxy-4-oxo-6-pyrrolidin-1-yl-1H-pyridin-3-yl)methyl]-6-hydroxy-4-oxo-2-pyrrolidin-1-yl-1H-pyridine-3-carboxylate Traditional Name: 5-[(5-carbethoxy-2-hydroxy-4-keto-6-pyrrolidino-1H-pyridin-3-yl)-(4-chloro-2-nitro-phenyl)methyl]-6-hydroxy-4-keto-2-pyrrolidino-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=C(C=C(C=C2)Cl)[N+](=O)[O-])C3=C(NC(=C(C3=O)C(=O)OCC)N4CCCC4)O)O)N5CCCC5

Isomeric SMILES

CCOC(=O)C1=C(NC(=C(C1=O)C(C2=C(C=C(C=C2)Cl)[N+](=O)[O-])C3=C(NC(=C(C3=O)C(=O)OCC)N4CCCC4)O)O)N5CCCC5

InChI

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