1-(4-chlorophenyl)-2-[4-(3-methylphenyl)pyrimidin-1-ium-1-yl]ethanone

Systemtic Name: 1-(4-chlorophenyl)-2-[4-(3-methylphenyl)pyrimidin-1-ium-1-yl]ethanone Openeye Name: 1-(4-chlorophenyl)-2-[4-(m-tolyl)pyrimidin-1-ium-1-yl]ethanone CAS Name: 1-(4-chlorophenyl)-2-[4-(3-methylphenyl)-1-pyrimidin-1-iumyl]ethanone IUPAC Name: 1-(4-chlorophenyl)-2-[4-(3-methylphenyl)pyrimidin-1-ium-1-yl]ethanone Traditional Name: 1-(4-chlorophenyl)-2-[4-(m-tolyl)pyrimidin-1-ium-1-yl]ethanone Formula: C19H16ClN2O+ MolecularWeight: 323.79614

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H16ClN2O/c1-14-3-2-4-16(11-14)18-9-10-22(13-21-18)12-19(23)15-5-7-17(20)8-6-15/h2-11,13H,12H2,1H3/q+1