1-oxidanyl-6-[4-(trifluoromethyl)phenyl]sulfanyl-hexan-2-one

Systemtic Name: 1-oxidanyl-6-[4-(trifluoromethyl)phenyl]sulfanyl-hexan-2-one Openeye Name: 1-hydroxy-6-[4-(trifluoromethyl)phenyl]sulfanyl-hexan-2-one CAS Name: 1-hydroxy-6-[[4-(trifluoromethyl)phenyl]thio]-2-hexanone IUPAC Name: 1-hydroxy-6-[4-(trifluoromethyl)phenyl]sulfanylhexan-2-one Traditional Name: 1-hydroxy-6-[[4-(trifluoromethyl)phenyl]thio]hexan-2-one Formula: C13H15F3O2S MolecularWeight: 292.31721

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(F)(F)F)SCCCCC(=O)CO

Isomeric SMILES

C1=CC(=CC=C1C(F)(F)F)SCCCCC(=O)CO

InChI

InChI=1S/C13H15F3O2S/c14-13(15,16)10-4-6-12(7-5-10)19-8-2-1-3-11(18)9-17/h4-7,17H,1-3,8-9H2