1-(4-bromophenyl)-2-(thiolan-1-ium-1-yl)ethanone bromide

Systemtic Name: 1-(4-bromophenyl)-2-(thiolan-1-ium-1-yl)ethanone bromide Openeye Name: 1-(4-bromophenyl)-2-tetrahydrothiophen-1-ium-1-yl-ethanone bromide CAS Name: 1-(4-bromophenyl)-2-(1-thiolan-1-iumyl)ethanone bromide IUPAC Name: 1-(4-bromophenyl)-2-(thiolan-1-ium-1-yl)ethanone bromide Traditional Name: 1-(4-bromophenyl)-2-tetrahydrothiophen-1-ium-1-yl-ethanone bromide Formula: C12H14Br2OS MolecularWeight: 366.11196

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[S+](C1)CC(=O)C2=CC=C(C=C2)Br.[Br-]

Isomeric SMILES

C1CC[S+](C1)CC(=O)C2=CC=C(C=C2)Br.[Br-]

InChI

InChI=1S/C12H14BrOS.BrH/c13-11-5-3-10(4-6-11)12(14)9-15-7-1-2-8-15;/h3-6H,1-2,7-9H2;1H/q+1;/p-1