8-[(1S,5S)-2-oxidanylidene-5-pentyl-cyclopent-3-en-1-yl]octanoic acid

Systemtic Name: 8-[(1S,5S)-2-oxidanylidene-5-pentyl-cyclopent-3-en-1-yl]octanoic acid Openeye Name: 8-[(1S,5S)-2-oxo-5-pentyl-cyclopent-3-en-1-yl]octanoic acid CAS Name: 8-[(1S,5S)-2-oxo-5-pentyl-1-cyclopent-3-enyl]octanoic acid IUPAC Name: 8-[(1S,5S)-2-oxo-5-pentylcyclopent-3-en-1-yl]octanoic acid Traditional Name: 8-[(1S,2S)-2-amyl-5-keto-cyclopent-3-en-1-yl]caprylic acid Formula: C18H30O3 MolecularWeight: 294.429

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1C=CC(=O)C1CCCCCCCC(=O)O

Isomeric SMILES

CCCCC[C@H]1C=CC(=O)[C@H]1CCCCCCCC(=O)O

InChI

InChI=1S/C18H30O3/c1-2-3-7-10-15-13-14-17(19)16(15)11-8-5-4-6-9-12-18(20)21/h13-16H,2-12H2,1H3,(H,20,21)/t15-,16-/m0/s1