4-[[(3-cyanophenyl)carbonylamino]methyl]benzoate

Systemtic Name: 4-[[(3-cyanophenyl)carbonylamino]methyl]benzoate Openeye Name: 4-[[(3-cyanobenzoyl)amino]methyl]benzoate CAS Name: 4-[[[(3-cyanophenyl)-oxomethyl]amino]methyl]benzoate IUPAC Name: 4-[[(3-cyanobenzoyl)amino]methyl]benzoate Traditional Name: 4-[[(3-cyanobenzoyl)amino]methyl]benzoate Formula: C16H11N2O3- MolecularWeight: 279.27014

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)[O-])C#N

Isomeric SMILES

C1=CC(=CC(=C1)C(=O)NCC2=CC=C(C=C2)C(=O)[O-])C#N

InChI

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