(E)-7-[(1R,2S)-2-octyl-5-oxidanylidene-cyclopentyl]hept-3-enoic acid

Systemtic Name: (E)-7-[(1R,2S)-2-octyl-5-oxidanylidene-cyclopentyl]hept-3-enoic acid Openeye Name: (E)-7-[(1R,2S)-2-octyl-5-oxo-cyclopentyl]hept-3-enoic acid CAS Name: (E)-7-[(1R,2S)-2-octyl-5-oxocyclopentyl]-3-heptenoic acid IUPAC Name: (E)-7-[(1R,2S)-2-octyl-5-oxocyclopentyl]hept-3-enoic acid Traditional Name: (E)-7-[(1R,5S)-2-keto-5-octyl-cyclopentyl]hept-3-enoic acid Formula: C20H34O3 MolecularWeight: 322.48216

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC1CCC(=O)C1CCCC=CCC(=O)O

Isomeric SMILES

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

InChI

InChI=1S/C20H34O3/c1-2-3-4-5-6-9-12-17-15-16-19(21)18(17)13-10-7-8-11-14-20(22)23/h8,11,17-18H,2-7,9-10,12-16H2,1H3,(H,22,23)/b11-8+/t17-,18+/m0/s1