[4-(phenylcarbamoyl)phenyl]methyl 3-nitrobenzoate

Systemtic Name: [4-(phenylcarbamoyl)phenyl]methyl 3-nitrobenzoate Openeye Name: [4-(phenylcarbamoyl)phenyl]methyl 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[anilino(oxo)methyl]phenyl]methyl ester IUPAC Name: [4-(phenylcarbamoyl)phenyl]methyl 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-(phenylcarbamoyl)benzyl] ester Formula: C21H16N2O5 MolecularWeight: 376.36214

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)COC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)COC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

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