[2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(2-oxidanylidenepyrrolidin-1-yl)benzoate

Systemtic Name: [2-[(2-methyl-4-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 2-(2-oxidanylidenepyrrolidin-1-yl)benzoate Openeye Name: [2-(2-methyl-4-nitro-anilino)-2-oxo-ethyl] 2-(2-oxopyrrolidin-1-yl)benzoate CAS Name: 2-(2-oxo-1-pyrrolidinyl)benzoic acid [2-(2-methyl-4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(2-methyl-4-nitroanilino)-2-oxoethyl] 2-(2-oxopyrrolidin-1-yl)benzoate Traditional Name: 2-(2-ketopyrrolidino)benzoic acid [2-keto-2-(2-methyl-4-nitro-anilino)ethyl] ester Formula: C20H19N3O6 MolecularWeight: 397.38136

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)COC(=O)C2=CC=CC=C2N3CCCC3=O

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)COC(=O)C2=CC=CC=C2N3CCCC3=O

InChI

InChI=1S/C20H19N3O6/c1-13-11-14(23(27)28)8-9-16(13)21-18(24)12-29-20(26)15-5-2-3-6-17(15)22-10-4-7-19(22)25/h2-3,5-6,8-9,11H,4,7,10,12H2,1H3,(H,21,24)