3-octyl-6-(trifluoromethyl)pyrimidin-4-one

Systemtic Name: 3-octyl-6-(trifluoromethyl)pyrimidin-4-one Openeye Name: 3-octyl-6-(trifluoromethyl)pyrimidin-4-one CAS Name: 3-octyl-6-(trifluoromethyl)-4-pyrimidinone IUPAC Name: 3-octyl-6-(trifluoromethyl)pyrimidin-4-one Traditional Name: 3-octyl-6-(trifluoromethyl)pyrimidin-4-one Formula: C13H19F3N2O MolecularWeight: 276.29797

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C=NC(=CC1=O)C(F)(F)F

Isomeric SMILES

CCCCCCCCN1C=NC(=CC1=O)C(F)(F)F

InChI

InChI=1S/C13H19F3N2O/c1-2-3-4-5-6-7-8-18-10-17-11(9-12(18)19)13(14,15)16/h9-10H,2-8H2,1H3