1-[4-(trifluoromethylsulfanyl)phenyl]butan-2-one

Systemtic Name: 1-[4-(trifluoromethylsulfanyl)phenyl]butan-2-one Openeye Name: 1-[4-(trifluoromethylsulfanyl)phenyl]butan-2-one CAS Name: 1-[4-(trifluoromethylthio)phenyl]-2-butanone IUPAC Name: 1-[4-(trifluoromethylsulfanyl)phenyl]butan-2-one Traditional Name: 1-[4-(trifluoromethylthio)phenyl]butan-2-one Formula: C11H11F3OS MolecularWeight: 248.26465

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)CC1=CC=C(C=C1)SC(F)(F)F

Isomeric SMILES

CCC(=O)CC1=CC=C(C=C1)SC(F)(F)F

InChI

InChI=1S/C11H11F3OS/c1-2-9(15)7-8-3-5-10(6-4-8)16-11(12,13)14/h3-6H,2,7H2,1H3