1-(3,4-dimethoxyphenyl)-2-pyrazin-1-ium-1-yl-ethanone bromide

Systemtic Name: 1-(3,4-dimethoxyphenyl)-2-pyrazin-1-ium-1-yl-ethanone bromide Openeye Name: 1-(3,4-dimethoxyphenyl)-2-pyrazin-1-ium-1-yl-ethanone bromide CAS Name: 1-(3,4-dimethoxyphenyl)-2-(1-pyrazin-1-iumyl)ethanone bromide IUPAC Name: 1-(3,4-dimethoxyphenyl)-2-pyrazin-1-ium-1-ylethanone bromide Traditional Name: 1-(3,4-dimethoxyphenyl)-2-pyrazin-1-ium-1-yl-ethanone bromide Formula: C14H15BrN2O3 MolecularWeight: 339.1845

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N2O3.BrH/c1-18-13-4-3-11(9-14(13)19-2)12(17)10-16-7-5-15-6-8-16;/h3-9H,10H2,1-2H3;1H/q+1;/p-1