2-[2-cyanoethyl(phenyl)carbamoyl]benzoic acid

Systemtic Name: 2-[2-cyanoethyl(phenyl)carbamoyl]benzoic acid Openeye Name: 2-[2-cyanoethyl(phenyl)carbamoyl]benzoic acid CAS Name: 2-[[N-(2-cyanoethyl)anilino]-oxomethyl]benzoic acid IUPAC Name: 2-[2-cyanoethyl(phenyl)carbamoyl]benzoic acid Traditional Name: 2-[2-cyanoethyl(phenyl)carbamoyl]benzoic acid Formula: C17H14N2O3 MolecularWeight: 294.30466

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H14N2O3/c18-11-6-12-19(13-7-2-1-3-8-13)16(20)14-9-4-5-10-15(14)17(21)22/h1-5,7-10H,6,12H2,(H,21,22)