(E)-7-[2-[(E)-3-oxidanyloct-1-enyl]-5-sulfanyl-cyclopentyl]hept-5-enoic acid

Systemtic Name: (E)-7-[2-[(E)-3-oxidanyloct-1-enyl]-5-sulfanyl-cyclopentyl]hept-5-enoic acid Openeye Name: (E)-7-[2-[(E)-3-hydroxyoct-1-enyl]-5-sulfanyl-cyclopentyl]hept-5-enoic acid CAS Name: (E)-7-[2-[(E)-3-hydroxyoct-1-enyl]-5-mercaptocyclopentyl]-5-heptenoic acid IUPAC Name: (E)-7-[2-[(E)-3-hydroxyoct-1-enyl]-5-sulfanylcyclopentyl]hept-5-enoic acid Traditional Name: (E)-7-[2-[(E)-3-hydroxyoct-1-enyl]-5-mercapto-cyclopentyl]hept-5-enoic acid Formula: C20H34O3S MolecularWeight: 354.54716

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1CCC(C1CC=CCCCC(=O)O)S)O

Isomeric SMILES

CCCCCC(/C=C/C1CCC(C1C/C=C/CCCC(=O)O)S)O

InChI

InChI=1S/C20H34O3S/c1-2-3-6-9-17(21)14-12-16-13-15-19(24)18(16)10-7-4-5-8-11-20(22)23/h4,7,12,14,16-19,21,24H,2-3,5-6,8-11,13,15H2,1H3,(H,22,23)/b7-4+,14-12+