[3-[(phenylmethyl)carbamoyl]phenyl] 4-nitrobenzoate

Systemtic Name: [3-[(phenylmethyl)carbamoyl]phenyl] 4-nitrobenzoate Openeye Name: [3-(benzylcarbamoyl)phenyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [3-[oxo-[(phenylmethyl)amino]methyl]phenyl] ester IUPAC Name: [3-(benzylcarbamoyl)phenyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [3-(benzylcarbamoyl)phenyl] ester Formula: C21H16N2O5 MolecularWeight: 376.36214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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