3-[[2-(trifluoromethyl)phenyl]methyl]pyran-2-one

Systemtic Name: 3-[[2-(trifluoromethyl)phenyl]methyl]pyran-2-one Openeye Name: 3-[[2-(trifluoromethyl)phenyl]methyl]pyran-2-one CAS Name: 3-[[2-(trifluoromethyl)phenyl]methyl]-2-pyranone IUPAC Name: 3-[[2-(trifluoromethyl)phenyl]methyl]pyran-2-one Traditional Name: 3-[2-(trifluoromethyl)benzyl]pyran-2-one Formula: C13H9F3O2 MolecularWeight: 254.20457

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC2=CC=COC2=O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)CC2=CC=COC2=O)C(F)(F)F

InChI

InChI=1S/C13H9F3O2/c14-13(15,16)11-6-2-1-4-9(11)8-10-5-3-7-18-12(10)17/h1-7H,8H2