[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 1-(4-butoxycarbonylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 1-(4-butoxycarbonylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(4-methyl-3-nitro-anilino)-2-oxo-ethyl] 1-(4-butoxycarbonylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-[4-[butoxy(oxo)methyl]phenyl]-5-oxo-3-pyrrolidinecarboxylic acid [2-(4-methyl-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-nitroanilino)-2-oxoethyl] 1-(4-butoxycarbonylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(4-butoxycarbonylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-keto-2-(4-methyl-3-nitro-anilino)ethyl] ester Formula: C25H27N3O8 MolecularWeight: 497.49718

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC(=C(C=C3)C)[N+](=O)[O-]

Isomeric SMILES

CCCCOC(=O)C1=CC=C(C=C1)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC(=C(C=C3)C)[N+](=O)[O-]

InChI

InChI=1S/C25H27N3O8/c1-3-4-11-35-24(31)17-6-9-20(10-7-17)27-14-18(12-23(27)30)25(32)36-15-22(29)26-19-8-5-16(2)21(13-19)28(33)34/h5-10,13,18H,3-4,11-12,14-15H2,1-2H3,(H,26,29)