6-(chloromethyl)-2-(3-methylphenyl)-1H-pyrimidin-4-one

Systemtic Name: 6-(chloromethyl)-2-(3-methylphenyl)-1H-pyrimidin-4-one Openeye Name: 6-(chloromethyl)-2-(m-tolyl)-1H-pyrimidin-4-one CAS Name: 6-(chloromethyl)-2-(3-methylphenyl)-1H-pyrimidin-4-one IUPAC Name: 6-(chloromethyl)-2-(3-methylphenyl)-1H-pyrimidin-4-one Traditional Name: 6-(chloromethyl)-2-(m-tolyl)-1H-pyrimidin-4-one Formula: C12H11ClN2O MolecularWeight: 234.68154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC(=O)C=C(N2)CCl

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC(=O)C=C(N2)CCl

InChI

InChI=1S/C12H11ClN2O/c1-8-3-2-4-9(5-8)12-14-10(7-13)6-11(16)15-12/h2-6H,7H2,1H3,(H,14,15,16)