[4-nitro-2-(2-phenylethanoylamino)phenyl] benzoate

Systemtic Name: [4-nitro-2-(2-phenylethanoylamino)phenyl] benzoate Openeye Name: [4-nitro-2-[(2-phenylacetyl)amino]phenyl] benzoate CAS Name: benzoic acid [4-nitro-2-[(1-oxo-2-phenylethyl)amino]phenyl] ester IUPAC Name: [4-nitro-2-[(2-phenylacetyl)amino]phenyl] benzoate Traditional Name: benzoic acid [4-nitro-2-[(2-phenylacetyl)amino]phenyl] ester Formula: C21H16N2O5 MolecularWeight: 376.36214

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC(=O)C3=CC=CC=C3

Isomeric SMILES

C1=CC=C(C=C1)CC(=O)NC2=C(C=CC(=C2)[N+](=O)[O-])OC(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H16N2O5/c24-20(13-15-7-3-1-4-8-15)22-18-14-17(23(26)27)11-12-19(18)28-21(25)16-9-5-2-6-10-16/h1-12,14H,13H2,(H,22,24)