2-[2-[4-(1-cyanoethyl)phenyl]ethyl]benzoic acid

Systemtic Name: 2-[2-[4-(1-cyanoethyl)phenyl]ethyl]benzoic acid Openeye Name: 2-[2-[4-(1-cyanoethyl)phenyl]ethyl]benzoic acid CAS Name: 2-[2-[4-(1-cyanoethyl)phenyl]ethyl]benzoic acid IUPAC Name: 2-[2-[4-(1-cyanoethyl)phenyl]ethyl]benzoic acid Traditional Name: 2-[2-[4-(1-cyanoethyl)phenyl]ethyl]benzoic acid Formula: C18H17NO2 MolecularWeight: 279.33308

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Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)C1=CC=C(C=C1)CCC2=CC=CC=C2C(=O)O

Isomeric SMILES

CC(C#N)C1=CC=C(C=C1)CCC2=CC=CC=C2C(=O)O

InChI

InChI=1S/C18H17NO2/c1-13(12-19)15-9-6-14(7-10-15)8-11-16-4-2-3-5-17(16)18(20)21/h2-7,9-10,13H,8,11H2,1H3,(H,20,21)