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

Systemtic Name: 1-(4-methoxyphenyl)-2-[4-(2-methylphenyl)pyrimidin-1-ium-1-yl]ethanone Openeye Name: 1-(4-methoxyphenyl)-2-[4-(o-tolyl)pyrimidin-1-ium-1-yl]ethanone CAS Name: 1-(4-methoxyphenyl)-2-[4-(2-methylphenyl)-1-pyrimidin-1-iumyl]ethanone IUPAC Name: 1-(4-methoxyphenyl)-2-[4-(2-methylphenyl)pyrimidin-1-ium-1-yl]ethanone Traditional Name: 1-(4-methoxyphenyl)-2-[4-(o-tolyl)pyrimidin-1-ium-1-yl]ethanone Formula: C20H19N2O2+ MolecularWeight: 319.37706

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=CC=CC=C1C2=NC=[N+](C=C2)CC(=O)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H19N2O2/c1-15-5-3-4-6-18(15)19-11-12-22(14-21-19)13-20(23)16-7-9-17(24-2)10-8-16/h3-12,14H,13H2,1-2H3/q+1