2-(phenylcarbonyl)hex-5-enoic acid

Systemtic Name: 2-(phenylcarbonyl)hex-5-enoic acid Openeye Name: 2-benzoylhex-5-enoic acid CAS Name: 2-benzoyl-5-hexenoic acid IUPAC Name: 2-benzoylhex-5-enoic acid Traditional Name: 2-benzoylhex-5-enoic acid Formula: C13H14O3 MolecularWeight: 218.24846

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CCCC(C(=O)C1=CC=CC=C1)C(=O)O

Isomeric SMILES

C=CCCC(C(=O)C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C13H14O3/c1-2-3-9-11(13(15)16)12(14)10-7-5-4-6-8-10/h2,4-8,11H,1,3,9H2,(H,15,16)