(E)-6-(3-cyanophenyl)hex-5-enoic acid

Systemtic Name: (E)-6-(3-cyanophenyl)hex-5-enoic acid Openeye Name: (E)-6-(3-cyanophenyl)hex-5-enoic acid CAS Name: (E)-6-(3-cyanophenyl)-5-hexenoic acid IUPAC Name: (E)-6-(3-cyanophenyl)hex-5-enoic acid Traditional Name: (E)-6-(3-cyanophenyl)hex-5-enoic acid Formula: C13H13NO2 MolecularWeight: 215.24782

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C=CCCCC(=O)O)C#N

Isomeric SMILES

C1=CC(=CC(=C1)/C=C/CCCC(=O)O)C#N

InChI

InChI=1S/C13H13NO2/c14-10-12-7-4-6-11(9-12)5-2-1-3-8-13(15)16/h2,4-7,9H,1,3,8H2,(H,15,16)/b5-2+