4-[2-cyanoethyl(phenyl)amino]benzoic acid

Systemtic Name: 4-[2-cyanoethyl(phenyl)amino]benzoic acid Openeye Name: 4-[N-(2-cyanoethyl)anilino]benzoic acid CAS Name: 4-[N-(2-cyanoethyl)anilino]benzoic acid IUPAC Name: 4-[N-(2-cyanoethyl)anilino]benzoic acid Traditional Name: 4-[N-(2-cyanoethyl)anilino]benzoic acid Formula: C16H14N2O2 MolecularWeight: 266.29456

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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