5-methyl-6-[1,1,2,2,2-pentakis(fluoranyl)ethyl]-1H-pyrimidin-4-one

Systemtic Name: 5-methyl-6-[1,1,2,2,2-pentakis(fluoranyl)ethyl]-1H-pyrimidin-4-one Openeye Name: 5-methyl-6-(1,1,2,2,2-pentafluoroethyl)-1H-pyrimidin-4-one CAS Name: 5-methyl-6-(1,1,2,2,2-pentafluoroethyl)-1H-pyrimidin-4-one IUPAC Name: 5-methyl-6-(1,1,2,2,2-pentafluoroethyl)-1H-pyrimidin-4-one Traditional Name: 5-methyl-6-(1,1,2,2,2-pentafluoroethyl)-1H-pyrimidin-4-one Formula: C7H5F5N2O MolecularWeight: 228.119416

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC=NC1=O)C(C(F)(F)F)(F)F

Isomeric SMILES

CC1=C(NC=NC1=O)C(C(F)(F)F)(F)F

InChI

InChI=1S/C7H5F5N2O/c1-3-4(13-2-14-5(3)15)6(8,9)7(10,11)12/h2H,1H3,(H,13,14,15)