[4-[2-[4-[(4-nitrophenyl)amino]-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] benzoate

Systemtic Name: [4-[2-[4-[(4-nitrophenyl)amino]-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] benzoate Openeye Name: [4-[2-[4-(4-nitroanilino)-4-oxo-butanoyl]oxyacetyl]phenyl] benzoate CAS Name: benzoic acid [4-[2-[4-(4-nitroanilino)-1,4-dioxobutoxy]-1-oxoethyl]phenyl] ester IUPAC Name: [4-[2-[4-(4-nitroanilino)-4-oxobutanoyl]oxyacetyl]phenyl] benzoate Traditional Name: benzoic acid [4-[2-[4-keto-4-(4-nitroanilino)butanoyl]oxyacetyl]phenyl] ester Formula: C25H20N2O8 MolecularWeight: 476.4349

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C25H20N2O8/c28-22(17-6-12-21(13-7-17)35-25(31)18-4-2-1-3-5-18)16-34-24(30)15-14-23(29)26-19-8-10-20(11-9-19)27(32)33/h1-13H,14-16H2,(H,26,29)