[2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-phenethylbenzoate

Systemtic Name: [2-[(4-nitrophenyl)amino]-2-oxidanylidene-ethyl] 2-phenethylbenzoate Openeye Name: [2-(4-nitroanilino)-2-oxo-ethyl] 2-phenethylbenzoate CAS Name: 2-phenethylbenzoic acid [2-(4-nitroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-nitroanilino)-2-oxoethyl] 2-phenethylbenzoate Traditional Name: 2-phenethylbenzoic acid [2-keto-2-(4-nitroanilino)ethyl] ester Formula: C23H20N2O5 MolecularWeight: 404.4153

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=CC=CC=C2C(=O)OCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCC2=CC=CC=C2C(=O)OCC(=O)NC3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H20N2O5/c26-22(24-19-12-14-20(15-13-19)25(28)29)16-30-23(27)21-9-5-4-8-18(21)11-10-17-6-2-1-3-7-17/h1-9,12-15H,10-11,16H2,(H,24,26)