[2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate

Systemtic Name: [2-[(4-methyl-3-nitro-phenyl)amino]-2-oxidanylidene-ethyl] 3-[2,5-bis(oxidanylidene)pyrrolidin-1-yl]benzoate Openeye Name: [2-(4-methyl-3-nitro-anilino)-2-oxo-ethyl] 3-(2,5-dioxopyrrolidin-1-yl)benzoate CAS Name: 3-(2,5-dioxo-1-pyrrolidinyl)benzoic acid [2-(4-methyl-3-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-methyl-3-nitroanilino)-2-oxoethyl] 3-(2,5-dioxopyrrolidin-1-yl)benzoate Traditional Name: 3-succinimidobenzoic acid [2-keto-2-(4-methyl-3-nitro-anilino)ethyl] ester Formula: C20H17N3O7 MolecularWeight: 411.36488

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)N3C(=O)CCC3=O)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)COC(=O)C2=CC(=CC=C2)N3C(=O)CCC3=O)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O7/c1-12-5-6-14(10-16(12)23(28)29)21-17(24)11-30-20(27)13-3-2-4-15(9-13)22-18(25)7-8-19(22)26/h2-6,9-10H,7-8,11H2,1H3,(H,21,24)