6-phenylheptanoate

Systemtic Name: 6-phenylheptanoate Openeye Name: 6-phenylheptanoate CAS Name: 6-phenylheptanoate IUPAC Name: 6-phenylheptanoate Traditional Name: 6-phenylenanthate Formula: C13H17O2- MolecularWeight: 205.27288

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCC(=O)[O-])C1=CC=CC=C1

Isomeric SMILES

CC(CCCCC(=O)[O-])C1=CC=CC=C1

InChI

InChI=1S/C13H18O2/c1-11(7-5-6-10-13(14)15)12-8-3-2-4-9-12/h2-4,8-9,11H,5-7,10H2,1H3,(H,14,15)/p-1