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

Systemtic Name: [4-[2-[4-[(4-nitrophenyl)amino]-4-oxidanylidene-butanoyl]oxyethanoyl]phenyl] 4-nitrobenzoate Openeye Name: [4-[2-[4-(4-nitroanilino)-4-oxo-butanoyl]oxyacetyl]phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [4-[2-[4-(4-nitroanilino)-1,4-dioxobutoxy]-1-oxoethyl]phenyl] ester IUPAC Name: [4-[2-[4-(4-nitroanilino)-4-oxobutanoyl]oxyacetyl]phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [4-[2-[4-keto-4-(4-nitroanilino)butanoyl]oxyacetyl]phenyl] ester Formula: C25H19N3O10 MolecularWeight: 521.43246

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)OC2=CC=C(C=C2)C(=O)COC(=O)CCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C25H19N3O10/c29-22(15-37-24(31)14-13-23(30)26-18-5-9-20(10-6-18)28(35)36)16-3-11-21(12-4-16)38-25(32)17-1-7-19(8-2-17)27(33)34/h1-12H,13-15H2,(H,26,30)