1-(4-methoxyphenyl)-2-(1-methylimidazo[4,5-c]pyridin-5-ium-5-yl)ethanone bromide

Systemtic Name: 1-(4-methoxyphenyl)-2-(1-methylimidazo[4,5-c]pyridin-5-ium-5-yl)ethanone bromide Openeye Name: 1-(4-methoxyphenyl)-2-(1-methylimidazo[4,5-c]pyridin-5-ium-5-yl)ethanone bromide CAS Name: 1-(4-methoxyphenyl)-2-(1-methyl-5-imidazo[4,5-c]pyridin-5-iumyl)ethanone bromide IUPAC Name: 1-(4-methoxyphenyl)-2-(1-methylimidazo[4,5-c]pyridin-5-ium-5-yl)ethanone bromide Traditional Name: 1-(4-methoxyphenyl)-2-(1-methylimidazo[4,5-c]pyridin-5-ium-5-yl)ethanone bromide Formula: C16H16BrN3O2 MolecularWeight: 362.22114

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C=C[N+](=C2)CC(=O)C3=CC=C(C=C3)OC.[Br-]

Isomeric SMILES

CN1C=NC2=C1C=C[N+](=C2)CC(=O)C3=CC=C(C=C3)OC.[Br-]

InChI

InChI=1S/C16H16N3O2.BrH/c1-18-11-17-14-9-19(8-7-15(14)18)10-16(20)12-3-5-13(21-2)6-4-12;/h3-9,11H,10H2,1-2H3;1H/q+1;/p-1