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

Systemtic Name: 1-(4-methoxyphenyl)-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanone bromide Openeye Name: 1-(4-methoxyphenyl)-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]ethanone bromide CAS Name: 1-(4-methoxyphenyl)-2-(4-pyridin-4-yl-1-pyridin-1-iumyl)ethanone bromide IUPAC Name: 1-(4-methoxyphenyl)-2-(4-pyridin-4-ylpyridin-1-ium-1-yl)ethanone bromide Traditional Name: 1-(4-methoxyphenyl)-2-[4-(4-pyridyl)pyridin-1-ium-1-yl]ethanone bromide Formula: C19H17BrN2O2 MolecularWeight: 385.25448

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C3=CC=NC=C3.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[N+]2=CC=C(C=C2)C3=CC=NC=C3.[Br-]

InChI

InChI=1S/C19H17N2O2.BrH/c1-23-18-4-2-17(3-5-18)19(22)14-21-12-8-16(9-13-21)15-6-10-20-11-7-15;/h2-13H,14H2,1H3;1H/q+1;/p-1