(E)-4,4-dimethyl-1-oxidanyl-5-[4-(trifluoromethylsulfanyl)phenyl]pent-1-en-3-one

Systemtic Name: (E)-4,4-dimethyl-1-oxidanyl-5-[4-(trifluoromethylsulfanyl)phenyl]pent-1-en-3-one Openeye Name: (E)-1-hydroxy-4,4-dimethyl-5-[4-(trifluoromethylsulfanyl)phenyl]pent-1-en-3-one CAS Name: (E)-1-hydroxy-4,4-dimethyl-5-[4-(trifluoromethylthio)phenyl]-1-penten-3-one IUPAC Name: (E)-1-hydroxy-4,4-dimethyl-5-[4-(trifluoromethylsulfanyl)phenyl]pent-1-en-3-one Traditional Name: (E)-1-hydroxy-4,4-dimethyl-5-[4-(trifluoromethylthio)phenyl]pent-1-en-3-one Formula: C14H15F3O2S MolecularWeight: 304.32791

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15F3O2S/c1-13(2,12(19)7-8-18)9-10-3-5-11(6-4-10)20-14(15,16)17/h3-8,18H,9H2,1-2H3/b8-7+