5-methyl-3-(phenylmethyl)-3-(trifluoromethyl)hex-5-en-2-one

Systemtic Name: 5-methyl-3-(phenylmethyl)-3-(trifluoromethyl)hex-5-en-2-one Openeye Name: 3-benzyl-5-methyl-3-(trifluoromethyl)hex-5-en-2-one CAS Name: 5-methyl-3-(phenylmethyl)-3-(trifluoromethyl)-5-hexen-2-one IUPAC Name: 3-benzyl-5-methyl-3-(trifluoromethyl)hex-5-en-2-one Traditional Name: 3-benzyl-5-methyl-3-(trifluoromethyl)hex-5-en-2-one Formula: C15H17F3O MolecularWeight: 270.29009

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17F3O/c1-11(2)9-14(12(3)19,15(16,17)18)10-13-7-5-4-6-8-13/h4-8H,1,9-10H2,2-3H3