[2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 1-(2,6-diethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(3-nitrophenyl)amino]-2-oxidanylidene-ethyl] 1-(2,6-diethylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(3-nitroanilino)-2-oxo-ethyl] 1-(2,6-diethylphenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(2,6-diethylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-nitroanilino)-2-oxoethyl] 1-(2,6-diethylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 1-(2,6-diethylphenyl)-5-keto-pyrrolidine-3-carboxylic acid [2-keto-2-(3-nitroanilino)ethyl] ester Formula: C23H25N3O6 MolecularWeight: 439.4611

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=CC=C1)CC)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CCC1=C(C(=CC=C1)CC)N2CC(CC2=O)C(=O)OCC(=O)NC3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H25N3O6/c1-3-15-7-5-8-16(4-2)22(15)25-13-17(11-21(25)28)23(29)32-14-20(27)24-18-9-6-10-19(12-18)26(30)31/h5-10,12,17H,3-4,11,13-14H2,1-2H3,(H,24,27)