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

Systemtic Name: [2-[(2,4-dimethylphenyl)amino]-2-oxidanylidene-ethyl] 1-(4-methyl-3-nitro-phenyl)-5-oxidanylidene-pyrrolidine-3-carboxylate Openeye Name: [2-(2,4-dimethylanilino)-2-oxo-ethyl] 1-(4-methyl-3-nitro-phenyl)-5-oxo-pyrrolidine-3-carboxylate CAS Name: 1-(4-methyl-3-nitrophenyl)-5-oxo-3-pyrrolidinecarboxylic acid [2-(2,4-dimethylanilino)-2-oxoethyl] ester IUPAC Name: [2-(2,4-dimethylanilino)-2-oxoethyl] 1-(4-methyl-3-nitrophenyl)-5-oxopyrrolidine-3-carboxylate Traditional Name: 5-keto-1-(4-methyl-3-nitro-phenyl)pyrrolidine-3-carboxylic acid [2-(2,4-dimethylanilino)-2-keto-ethyl] ester Formula: C22H23N3O6 MolecularWeight: 425.43452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)C)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)COC(=O)C2CC(=O)N(C2)C3=CC(=C(C=C3)C)[N+](=O)[O-])C

InChI

InChI=1S/C22H23N3O6/c1-13-4-7-18(15(3)8-13)23-20(26)12-31-22(28)16-9-21(27)24(11-16)17-6-5-14(2)19(10-17)25(29)30/h4-8,10,16H,9,11-12H2,1-3H3,(H,23,26)