6-[4-oxidanyl-5-[(E)-3-oxidanyloct-1-enyl]-2-(trifluoromethyl)cyclopenten-1-yl]sulfanylhexanoic acid

Systemtic Name: 6-[4-oxidanyl-5-[(E)-3-oxidanyloct-1-enyl]-2-(trifluoromethyl)cyclopenten-1-yl]sulfanylhexanoic acid Openeye Name: 6-[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-(trifluoromethyl)cyclopenten-1-yl]sulfanylhexanoic acid CAS Name: 6-[[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-(trifluoromethyl)-1-cyclopentenyl]thio]hexanoic acid IUPAC Name: 6-[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-(trifluoromethyl)cyclopenten-1-yl]sulfanylhexanoic acid Traditional Name: 6-[[4-hydroxy-5-[(E)-3-hydroxyoct-1-enyl]-2-(trifluoromethyl)cyclopenten-1-yl]thio]hexanoic acid Formula: C20H31F3O4S MolecularWeight: 424.51795

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C=CC1C(CC(=C1SCCCCCC(=O)O)C(F)(F)F)O)O

Isomeric SMILES

CCCCCC(/C=C/C1C(CC(=C1SCCCCCC(=O)O)C(F)(F)F)O)O

InChI

InChI=1S/C20H31F3O4S/c1-2-3-5-8-14(24)10-11-15-17(25)13-16(20(21,22)23)19(15)28-12-7-4-6-9-18(26)27/h10-11,14-15,17,24-25H,2-9,12-13H2,1H3,(H,26,27)/b11-10+