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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CC(CCSC1=CC=C(C=C1)C(F)(F)F)O

Isomeric SMILES

CC(=O)CC(CCSC1=CC=C(C=C1)C(F)(F)F)O

InChI

InChI=1S/C13H15F3O2S/c1-9(17)8-11(18)6-7-19-12-4-2-10(3-5-12)13(14,15)16/h2-5,11,18H,6-8H2,1H3