1-(4-methoxyphenyl)-2-pyrazin-1-ium-1-yl-ethanone bromide

Systemtic Name: 1-(4-methoxyphenyl)-2-pyrazin-1-ium-1-yl-ethanone bromide Openeye Name: 1-(4-methoxyphenyl)-2-pyrazin-1-ium-1-yl-ethanone bromide CAS Name: 1-(4-methoxyphenyl)-2-(1-pyrazin-1-iumyl)ethanone bromide IUPAC Name: 1-(4-methoxyphenyl)-2-pyrazin-1-ium-1-ylethanone bromide Traditional Name: 1-(4-methoxyphenyl)-2-pyrazin-1-ium-1-yl-ethanone bromide Formula: C13H13BrN2O2 MolecularWeight: 309.15852

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H13N2O2.BrH/c1-17-12-4-2-11(3-5-12)13(16)10-15-8-6-14-7-9-15;/h2-9H,10H2,1H3;1H/q+1;/p-1