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

Systemtic Name: 1-phenyl-2-(4-phenylpyrimidin-1-ium-1-yl)ethanone bromide Openeye Name: 1-phenyl-2-(4-phenylpyrimidin-1-ium-1-yl)ethanone bromide CAS Name: 1-phenyl-2-(4-phenyl-1-pyrimidin-1-iumyl)ethanone bromide IUPAC Name: 1-phenyl-2-(4-phenylpyrimidin-1-ium-1-yl)ethanone bromide Traditional Name: 1-phenyl-2-(4-phenylpyrimidin-1-ium-1-yl)ethanone bromide Formula: C18H15BrN2O MolecularWeight: 355.2285

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=NC=[N+](C=C2)CC(=O)C3=CC=CC=C3.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C2=NC=[N+](C=C2)CC(=O)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C18H15N2O.BrH/c21-18(16-9-5-2-6-10-16)13-20-12-11-17(19-14-20)15-7-3-1-4-8-15;/h1-12,14H,13H2;1H/q+1;/p-1