1-(4-methoxyphenyl)-2-(3-methylpyridazin-1-ium-1-yl)ethanone bromide

Systemtic Name: 1-(4-methoxyphenyl)-2-(3-methylpyridazin-1-ium-1-yl)ethanone bromide Openeye Name: 1-(4-methoxyphenyl)-2-(3-methylpyridazin-1-ium-1-yl)ethanone bromide CAS Name: 1-(4-methoxyphenyl)-2-(3-methyl-1-pyridazin-1-iumyl)ethanone bromide IUPAC Name: 1-(4-methoxyphenyl)-2-(3-methylpyridazin-1-ium-1-yl)ethanone bromide Traditional Name: 1-(4-methoxyphenyl)-2-(3-methylpyridazin-1-ium-1-yl)ethanone bromide Formula: C14H15BrN2O2 MolecularWeight: 323.1851

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N2O2.BrH/c1-11-4-3-9-16(15-11)10-14(17)12-5-7-13(18-2)8-6-12;/h3-9H,10H2,1-2H3;1H/q+1;/p-1