2-(4-fluoranyloctan-2-ylsulfanyl)hexanoic acid

Systemtic Name: 2-(4-fluoranyloctan-2-ylsulfanyl)hexanoic acid Openeye Name: 2-(3-fluoro-1-methyl-heptyl)sulfanylhexanoic acid CAS Name: 2-(4-fluorooctan-2-ylthio)hexanoic acid IUPAC Name: 2-(4-fluorooctan-2-ylsulfanyl)hexanoic acid Traditional Name: 2-[(3-fluoro-1-methyl-heptyl)thio]hexanoic acid Formula: C14H27FO2S MolecularWeight: 278.426383

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC(C)SC(CCCC)C(=O)O)F

Isomeric SMILES

CCCCC(CC(C)SC(CCCC)C(=O)O)F

InChI

InChI=1S/C14H27FO2S/c1-4-6-8-12(15)10-11(3)18-13(14(16)17)9-7-5-2/h11-13H,4-10H2,1-3H3,(H,16,17)