2-(4-cyanophenyl)-4-ethyl-benzoic acid

Systemtic Name: 2-(4-cyanophenyl)-4-ethyl-benzoic acid Openeye Name: 2-(4-cyanophenyl)-4-ethyl-benzoic acid CAS Name: 2-(4-cyanophenyl)-4-ethylbenzoic acid IUPAC Name: 2-(4-cyanophenyl)-4-ethylbenzoic acid Traditional Name: 2-(4-cyanophenyl)-4-ethyl-benzoic acid Formula: C16H13NO2 MolecularWeight: 251.27992

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)C(=O)O)C2=CC=C(C=C2)C#N

Isomeric SMILES

CCC1=CC(=C(C=C1)C(=O)O)C2=CC=C(C=C2)C#N

InChI

InChI=1S/C16H13NO2/c1-2-11-5-8-14(16(18)19)15(9-11)13-6-3-12(10-17)4-7-13/h3-9H,2H2,1H3,(H,18,19)