8-[(1R,2R,3R)-2-(4-fluoranyl-3-oxidanylidene-octyl)-3-oxidanyl-5-oxidanylidene-cyclopentyl]octanoic acid

Systemtic Name: 8-[(1R,2R,3R)-2-(4-fluoranyl-3-oxidanylidene-octyl)-3-oxidanyl-5-oxidanylidene-cyclopentyl]octanoic acid Openeye Name: 8-[(1R,2R,3R)-2-(4-fluoro-3-oxo-octyl)-3-hydroxy-5-oxo-cyclopentyl]octanoic acid CAS Name: 8-[(1R,2R,3R)-2-(4-fluoro-3-oxooctyl)-3-hydroxy-5-oxocyclopentyl]octanoic acid IUPAC Name: 8-[(1R,2R,3R)-2-(4-fluoro-3-oxooctyl)-3-hydroxy-5-oxocyclopentyl]octanoic acid Traditional Name: 8-[(1R,2R,3R)-2-(4-fluoro-3-keto-octyl)-3-hydroxy-5-keto-cyclopentyl]caprylic acid Formula: C21H35FO5 MolecularWeight: 386.498003

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C(=O)CCC1C(CC(=O)C1CCCCCCCC(=O)O)O)F

Isomeric SMILES

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

InChI

InChI=1S/C21H35FO5/c1-2-3-10-17(22)18(23)13-12-16-15(19(24)14-20(16)25)9-7-5-4-6-8-11-21(26)27/h15-17,20,25H,2-14H2,1H3,(H,26,27)/t15-,16-,17?,20-/m1/s1