1-(3-methoxyphenyl)-2-(1,3-thiazol-3-ium-3-yl)ethanone bromide

Systemtic Name: 1-(3-methoxyphenyl)-2-(1,3-thiazol-3-ium-3-yl)ethanone bromide Openeye Name: 1-(3-methoxyphenyl)-2-thiazol-3-ium-3-yl-ethanone bromide CAS Name: 1-(3-methoxyphenyl)-2-(3-thiazol-3-iumyl)ethanone bromide IUPAC Name: 1-(3-methoxyphenyl)-2-(1,3-thiazol-3-ium-3-yl)ethanone bromide Traditional Name: 1-(3-methoxyphenyl)-2-thiazol-3-ium-3-yl-ethanone bromide Formula: C12H12BrNO2S MolecularWeight: 314.19818

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H12NO2S.BrH/c1-15-11-4-2-3-10(7-11)12(14)8-13-5-6-16-9-13;/h2-7,9H,8H2,1H3;1H/q+1;/p-1