[2-[(5-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 1-(2-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate

Systemtic Name: [2-[(5-methoxy-2-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 1-(2-methylphenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(5-methoxy-2-nitro-anilino)-2-oxo-ethyl] 1-(o-tolyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(2-methylphenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(5-methoxy-2-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(5-methoxy-2-nitroanilino)-2-oxoethyl] 1-(2-methylphenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(o-tolyl)pyrrolidine-3-carboxylic acid [2-keto-2-(5-methoxy-2-nitro-anilino)ethyl] ester Formula: C21H21N3O7 MolecularWeight: 427.40734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2CC(CC2=O)C(=O)OCC(=O)NC3=C(C=CC(=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=CC=C1N2CC(CC2=O)C(=O)OCC(=O)NC3=C(C=CC(=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O7/c1-13-5-3-4-6-17(13)23-11-14(9-20(23)26)21(27)31-12-19(25)22-16-10-15(30-2)7-8-18(16)24(28)29/h3-8,10,14H,9,11-12H2,1-2H3,(H,22,25)