1-(5-bromanylthiophen-2-yl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide

Systemtic Name: 1-(5-bromanylthiophen-2-yl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide Openeye Name: 1-(5-bromo-2-thienyl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide CAS Name: 1-(5-bromo-2-thiophenyl)-2-(3-methyl-1-imidazol-3-iumyl)ethanone bromide IUPAC Name: 1-(5-bromothiophen-2-yl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide Traditional Name: 1-(5-bromo-2-thienyl)-2-(3-methylimidazol-3-ium-1-yl)ethanone bromide Formula: C10H10Br2N2OS MolecularWeight: 366.0722

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CN(C=C1)CC(=O)C2=CC=C(S2)Br.[Br-]

Isomeric SMILES

C[N+]1=CN(C=C1)CC(=O)C2=CC=C(S2)Br.[Br-]

InChI

InChI=1S/C10H10BrN2OS.BrH/c1-12-4-5-13(7-12)6-8(14)9-2-3-10(11)15-9;/h2-5,7H,6H2,1H3;1H/q+1;/p-1