[(2S)-1,1,1-tris(fluoranyl)octan-2-yl]sulfanylbenzene

Systemtic Name: [(2S)-1,1,1-tris(fluoranyl)octan-2-yl]sulfanylbenzene Openeye Name: [(1S)-1-(trifluoromethyl)heptyl]sulfanylbenzene CAS Name: [[(2S)-1,1,1-trifluorooctan-2-yl]thio]benzene IUPAC Name: [(2S)-1,1,1-trifluorooctan-2-yl]sulfanylbenzene Traditional Name: [[(1S)-1-(trifluoromethyl)heptyl]thio]benzene Formula: C14H19F3S MolecularWeight: 276.36087

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCCCCC[C@@H](C(F)(F)F)SC1=CC=CC=C1

InChI

InChI=1S/C14H19F3S/c1-2-3-4-8-11-13(14(15,16)17)18-12-9-6-5-7-10-12/h5-7,9-10,13H,2-4,8,11H2,1H3/t13-/m0/s1