5-(phenylcarbonyl)octanoic acid

Systemtic Name: 5-(phenylcarbonyl)octanoic acid Openeye Name: 5-benzoyloctanoic acid CAS Name: 5-benzoyloctanoic acid IUPAC Name: 5-benzoyloctanoic acid Traditional Name: 5-benzoylcaprylic acid Formula: C15H20O3 MolecularWeight: 248.3175

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20O3/c1-2-7-12(10-6-11-14(16)17)15(18)13-8-4-3-5-9-13/h3-5,8-9,12H,2,6-7,10-11H2,1H3,(H,16,17)