2-[2-cyanoethyl(phenyl)amino]benzoate

Systemtic Name: 2-[2-cyanoethyl(phenyl)amino]benzoate Openeye Name: 2-[N-(2-cyanoethyl)anilino]benzoate CAS Name: 2-[N-(2-cyanoethyl)anilino]benzoate IUPAC Name: 2-[N-(2-cyanoethyl)anilino]benzoate Traditional Name: 2-[N-(2-cyanoethyl)anilino]benzoate Formula: C16H13N2O2- MolecularWeight: 265.28662

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CCC#N)C2=CC=CC=C2C(=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)N(CCC#N)C2=CC=CC=C2C(=O)[O-]

InChI

InChI=1S/C16H14N2O2/c17-11-6-12-18(13-7-2-1-3-8-13)15-10-5-4-9-14(15)16(19)20/h1-5,7-10H,6,12H2,(H,19,20)/p-1