4-[[(4-cyanophenyl)carbonylamino]methyl]benzoic acid

Systemtic Name: 4-[[(4-cyanophenyl)carbonylamino]methyl]benzoic acid Openeye Name: 4-[[(4-cyanobenzoyl)amino]methyl]benzoic acid CAS Name: 4-[[[(4-cyanophenyl)-oxomethyl]amino]methyl]benzoic acid IUPAC Name: 4-[[(4-cyanobenzoyl)amino]methyl]benzoic acid Traditional Name: 4-[[(4-cyanobenzoyl)amino]methyl]benzoic acid Formula: C16H12N2O3 MolecularWeight: 280.27808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNC(=O)C2=CC=C(C=C2)C#N)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1CNC(=O)C2=CC=C(C=C2)C#N)C(=O)O

InChI

InChI=1S/C16H12N2O3/c17-9-11-1-5-13(6-2-11)15(19)18-10-12-3-7-14(8-4-12)16(20)21/h1-8H,10H2,(H,18,19)(H,20,21)