2-[5-methyl-2-(5-methylpyridin-2-yl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide

Systemtic Name: 2-[5-methyl-2-(5-methylpyridin-2-yl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide Openeye Name: 2-[5-methyl-2-(5-methyl-2-pyridyl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide CAS Name: 2-[5-methyl-2-(5-methyl-2-pyridinyl)-1-pyridin-1-iumyl]-1-phenylethanone bromide IUPAC Name: 2-[5-methyl-2-(5-methylpyridin-2-yl)pyridin-1-ium-1-yl]-1-phenylethanone bromide Traditional Name: 2-[5-methyl-2-(5-methyl-2-pyridyl)pyridin-1-ium-1-yl]-1-phenyl-ethanone bromide Formula: C20H19BrN2O MolecularWeight: 383.28166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN=C(C=C1)C2=[N+](C=C(C=C2)C)CC(=O)C3=CC=CC=C3.[Br-]

Isomeric SMILES

CC1=CN=C(C=C1)C2=[N+](C=C(C=C2)C)CC(=O)C3=CC=CC=C3.[Br-]

InChI

InChI=1S/C20H19N2O.BrH/c1-15-8-10-18(21-12-15)19-11-9-16(2)13-22(19)14-20(23)17-6-4-3-5-7-17;/h3-13H,14H2,1-2H3;1H/q+1;/p-1