(E)-1-[2-(trifluoromethyl)phenyl]sulfanylhex-3-en-2-one

Systemtic Name: (E)-1-[2-(trifluoromethyl)phenyl]sulfanylhex-3-en-2-one Openeye Name: (E)-1-[2-(trifluoromethyl)phenyl]sulfanylhex-3-en-2-one CAS Name: (E)-1-[[2-(trifluoromethyl)phenyl]thio]-3-hexen-2-one IUPAC Name: (E)-1-[2-(trifluoromethyl)phenyl]sulfanylhex-3-en-2-one Traditional Name: (E)-1-[[2-(trifluoromethyl)phenyl]thio]hex-3-en-2-one Formula: C13H13F3OS MolecularWeight: 274.30193

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Descriptors Computed from Structure

Canonical SMILES:

CCC=CC(=O)CSC1=CC=CC=C1C(F)(F)F

Isomeric SMILES

CC/C=C/C(=O)CSC1=CC=CC=C1C(F)(F)F

InChI

InChI=1S/C13H13F3OS/c1-2-3-6-10(17)9-18-12-8-5-4-7-11(12)13(14,15)16/h3-8H,2,9H2,1H3/b6-3+