2-(4-fluorophenyl)sulfanyloctanoic acid

Systemtic Name: 2-(4-fluorophenyl)sulfanyloctanoic acid Openeye Name: 2-(4-fluorophenyl)sulfanyloctanoic acid CAS Name: 2-[(4-fluorophenyl)thio]octanoic acid IUPAC Name: 2-(4-fluorophenyl)sulfanyloctanoic acid Traditional Name: 2-[(4-fluorophenyl)thio]caprylic acid Formula: C14H19FO2S MolecularWeight: 270.362863

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C(=O)O)SC1=CC=C(C=C1)F

Isomeric SMILES

CCCCCCC(C(=O)O)SC1=CC=C(C=C1)F

InChI

InChI=1S/C14H19FO2S/c1-2-3-4-5-6-13(14(16)17)18-12-9-7-11(15)8-10-12/h7-10,13H,2-6H2,1H3,(H,16,17)