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

Systemtic Name: [4-[(4-methylphenyl)carbamoyl]phenyl] 3-nitrobenzoate Openeye Name: [4-(p-tolylcarbamoyl)phenyl] 3-nitrobenzoate CAS Name: 3-nitrobenzoic acid [4-[(4-methylanilino)-oxomethyl]phenyl] ester IUPAC Name: [4-[(4-methylphenyl)carbamoyl]phenyl] 3-nitrobenzoate Traditional Name: 3-nitrobenzoic acid [4-(p-tolylcarbamoyl)phenyl] ester Formula: C21H16N2O5 MolecularWeight: 376.36214

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)OC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H16N2O5/c1-14-5-9-17(10-6-14)22-20(24)15-7-11-19(12-8-15)28-21(25)16-3-2-4-18(13-16)23(26)27/h2-13H,1H3,(H,22,24)