1-phenyl-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanone bromide

Systemtic Name: 1-phenyl-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanone bromide Openeye Name: 1-phenyl-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]ethanone bromide CAS Name: 1-phenyl-2-(4-pyridin-4-yl-1-pyridin-1-iumyl)ethanone bromide IUPAC Name: 1-phenyl-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanone bromide Traditional Name: 1-phenyl-2-[4-(4-pyridyl)pyridin-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)C(=O)C[N+]2=CC=C(C=C2)C3=CC=NC=C3.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C3=CC=NC=C3.[Br-]

InChI

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