8-[(1S,2S)-2-[(E)-hex-1-enyl]-5-oxidanylidene-cyclopentyl]octanoic acid

Systemtic Name: 8-[(1S,2S)-2-[(E)-hex-1-enyl]-5-oxidanylidene-cyclopentyl]octanoic acid Openeye Name: 8-[(1S,2S)-2-[(E)-hex-1-enyl]-5-oxo-cyclopentyl]octanoic acid CAS Name: 8-[(1S,2S)-2-[(E)-hex-1-enyl]-5-oxocyclopentyl]octanoic acid IUPAC Name: 8-[(1S,2S)-2-[(E)-hex-1-enyl]-5-oxocyclopentyl]octanoic acid Traditional Name: 8-[(1S,2S)-2-[(E)-hex-1-enyl]-5-keto-cyclopentyl]caprylic acid Formula: C19H32O3 MolecularWeight: 308.45558

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC1CCC(=O)C1CCCCCCCC(=O)O

Isomeric SMILES

CCCC/C=C/[C@@H]1CCC(=O)[C@H]1CCCCCCCC(=O)O

InChI

InChI=1S/C19H32O3/c1-2-3-4-8-11-16-14-15-18(20)17(16)12-9-6-5-7-10-13-19(21)22/h8,11,16-17H,2-7,9-10,12-15H2,1H3,(H,21,22)/b11-8+/t16-,17+/m1/s1