[3-[(phenylmethyl)carbamoyl]phenyl] 2-chloranyl-4-nitro-benzoate

Systemtic Name: [3-[(phenylmethyl)carbamoyl]phenyl] 2-chloranyl-4-nitro-benzoate Openeye Name: [3-(benzylcarbamoyl)phenyl] 2-chloro-4-nitro-benzoate CAS Name: 2-chloro-4-nitrobenzoic acid [3-[oxo-[(phenylmethyl)amino]methyl]phenyl] ester IUPAC Name: [3-(benzylcarbamoyl)phenyl] 2-chloro-4-nitrobenzoate Traditional Name: 2-chloro-4-nitro-benzoic acid [3-(benzylcarbamoyl)phenyl] ester Formula: C21H15ClN2O5 MolecularWeight: 410.8072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H15ClN2O5/c22-19-12-16(24(27)28)9-10-18(19)21(26)29-17-8-4-7-15(11-17)20(25)23-13-14-5-2-1-3-6-14/h1-12H,13H2,(H,23,25)