2-(4-methylpyrimidin-1-ium-1-yl)-1-phenyl-ethanone bromide

Systemtic Name: 2-(4-methylpyrimidin-1-ium-1-yl)-1-phenyl-ethanone bromide Openeye Name: 2-(4-methylpyrimidin-1-ium-1-yl)-1-phenyl-ethanone bromide CAS Name: 2-(4-methyl-1-pyrimidin-1-iumyl)-1-phenylethanone bromide IUPAC Name: 2-(4-methylpyrimidin-1-ium-1-yl)-1-phenylethanone bromide Traditional Name: 2-(4-methylpyrimidin-1-ium-1-yl)-1-phenyl-ethanone bromide Formula: C13H13BrN2O MolecularWeight: 293.15912

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC=[N+](C=C1)CC(=O)C2=CC=CC=C2.[Br-]

Isomeric SMILES

CC1=NC=[N+](C=C1)CC(=O)C2=CC=CC=C2.[Br-]

InChI

InChI=1S/C13H13N2O.BrH/c1-11-7-8-15(10-14-11)9-13(16)12-5-3-2-4-6-12;/h2-8,10H,9H2,1H3;1H/q+1;/p-1