4,4,4-tris(fluoranyl)-1-(3-methylphenyl)-3-(trifluoromethyl)but-2-en-1-one

Systemtic Name: 4,4,4-tris(fluoranyl)-1-(3-methylphenyl)-3-(trifluoromethyl)but-2-en-1-one Openeye Name: 4,4,4-trifluoro-1-(m-tolyl)-3-(trifluoromethyl)but-2-en-1-one CAS Name: 4,4,4-trifluoro-1-(3-methylphenyl)-3-(trifluoromethyl)-2-buten-1-one IUPAC Name: 4,4,4-trifluoro-1-(3-methylphenyl)-3-(trifluoromethyl)but-2-en-1-one Traditional Name: 4,4,4-trifluoro-1-(m-tolyl)-3-(trifluoromethyl)but-2-en-1-one Formula: C12H8F6O MolecularWeight: 282.181739

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H8F6O/c1-7-3-2-4-8(5-7)9(19)6-10(11(13,14)15)12(16,17)18/h2-6H,1H3