2-phenyloctanoic acid

Systemtic Name: 2-phenyloctanoic acid Openeye Name: 2-phenyloctanoic acid CAS Name: 2-phenyloctanoic acid IUPAC Name: 2-phenyloctanoic acid Traditional Name: 2-phenylcaprylic acid Formula: C14H20O2 MolecularWeight: 220.3074

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C1=CC=CC=C1)C(=O)O

Isomeric SMILES

CCCCCCC(C1=CC=CC=C1)C(=O)O

InChI

InChI=1S/C14H20O2/c1-2-3-4-8-11-13(14(15)16)12-9-6-5-7-10-12/h5-7,9-10,13H,2-4,8,11H2,1H3,(H,15,16)