2-(4-fluoranyldecan-2-ylsulfanyl)octanoate

Systemtic Name: 2-(4-fluoranyldecan-2-ylsulfanyl)octanoate Openeye Name: 2-(3-fluoro-1-methyl-nonyl)sulfanyloctanoate CAS Name: 2-(4-fluorodecan-2-ylthio)octanoate IUPAC Name: 2-(4-fluorodecan-2-ylsulfanyl)octanoate Traditional Name: 2-[(3-fluoro-1-methyl-nonyl)thio]caprylate Formula: C18H34FO2S- MolecularWeight: 333.524763

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(CC(C)SC(CCCCCC)C(=O)[O-])F

Isomeric SMILES

CCCCCCC(CC(C)SC(CCCCCC)C(=O)[O-])F

InChI

InChI=1S/C18H35FO2S/c1-4-6-8-10-12-16(19)14-15(3)22-17(18(20)21)13-11-9-7-5-2/h15-17H,4-14H2,1-3H3,(H,20,21)/p-1