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

Systemtic Name: 1-(4-phenylphenyl)-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanone bromide Openeye Name: 1-(4-phenylphenyl)-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]ethanone bromide CAS Name: 1-(4-phenylphenyl)-2-(4-pyridin-4-yl-1-pyridin-1-iumyl)ethanone bromide IUPAC Name: 1-(4-phenylphenyl)-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanone bromide Traditional Name: 1-(4-phenylphenyl)-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]ethanone bromide Formula: C24H19BrN2O MolecularWeight: 431.32446

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C[N+]3=CC=C(C=C3)C4=CC=NC=C4.[Br-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)C[N+]3=CC=C(C=C3)C4=CC=NC=C4.[Br-]

InChI

InChI=1S/C24H19N2O.BrH/c27-24(23-8-6-20(7-9-23)19-4-2-1-3-5-19)18-26-16-12-22(13-17-26)21-10-14-25-15-11-21;/h1-17H,18H2;1H/q+1;/p-1