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

Systemtic Name: 2-(3-bromanylpyridin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide Openeye Name: 2-(3-bromopyridin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide CAS Name: 2-(3-bromo-1-pyridin-1-iumyl)-1-(4-methoxyphenyl)ethanone bromide IUPAC Name: 2-(3-bromopyridin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide Traditional Name: 2-(3-bromopyridin-1-ium-1-yl)-1-(4-methoxyphenyl)ethanone bromide Formula: C14H13Br2NO2 MolecularWeight: 387.06652

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H13BrNO2.BrH/c1-18-13-6-4-11(5-7-13)14(17)10-16-8-2-3-12(15)9-16;/h2-9H,10H2,1H3;1H/q+1;/p-1