2-(4,5-dihydro-1,3-thiazol-3-ium-3-yl)-1-(4-methoxyphenyl)ethanone bromide

Systemtic Name: 2-(4,5-dihydro-1,3-thiazol-3-ium-3-yl)-1-(4-methoxyphenyl)ethanone bromide Openeye Name: 2-(4,5-dihydrothiazol-3-ium-3-yl)-1-(4-methoxyphenyl)ethanone bromide CAS Name: 2-(4,5-dihydrothiazol-3-ium-3-yl)-1-(4-methoxyphenyl)ethanone bromide IUPAC Name: 2-(4,5-dihydro-1,3-thiazol-3-ium-3-yl)-1-(4-methoxyphenyl)ethanone bromide Traditional Name: 1-(4-methoxyphenyl)-2-(2-thiazolin-3-ium-3-yl)ethanone bromide Formula: C12H14BrNO2S MolecularWeight: 316.21406

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(=O)C[N+]2=CSCC2.[Br-]

Isomeric SMILES

COC1=CC=C(C=C1)C(=O)C[N+]2=CSCC2.[Br-]

InChI

InChI=1S/C12H14NO2S.BrH/c1-15-11-4-2-10(3-5-11)12(14)8-13-6-7-16-9-13;/h2-5,9H,6-8H2,1H3;1H/q+1;/p-1