3-(phenylcarbonyl)pentan-3-ylsulfanium bromide

Systemtic Name: 3-(phenylcarbonyl)pentan-3-ylsulfanium bromide Openeye Name: (1-benzoyl-1-ethyl-propyl)sulfonium bromide CAS Name: 3-benzoylpentan-3-ylsulfonium bromide IUPAC Name: 3-benzoylpentan-3-ylsulfanium bromide Traditional Name: (1-benzoyl-1-ethyl-propyl)sulfonium bromide Formula: C12H17BrOS MolecularWeight: 289.23178

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)(C(=O)C1=CC=CC=C1)[SH2+].[Br-]

Isomeric SMILES

CCC(CC)(C(=O)C1=CC=CC=C1)[SH2+].[Br-]

InChI

InChI=1S/C12H16OS.BrH/c1-3-12(14,4-2)11(13)10-8-6-5-7-9-10;/h5-9,14H,3-4H2,1-2H3;1H