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

Systemtic Name: 2-[4-(4-methylphenyl)pyrimidin-1-ium-1-yl]-1-phenyl-ethanone Openeye Name: 1-phenyl-2-[4-(p-tolyl)pyrimidin-1-ium-1-yl]ethanone CAS Name: 2-[4-(4-methylphenyl)-1-pyrimidin-1-iumyl]-1-phenylethanone IUPAC Name: 2-[4-(4-methylphenyl)pyrimidin-1-ium-1-yl]-1-phenylethanone Traditional Name: 1-phenyl-2-[4-(p-tolyl)pyrimidin-1-ium-1-yl]ethanone Formula: C19H17N2O+ MolecularWeight: 289.35108

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H17N2O/c1-15-7-9-16(10-8-15)18-11-12-21(14-20-18)13-19(22)17-5-3-2-4-6-17/h2-12,14H,13H2,1H3/q+1