1-(thian-1-ium-2-yl)butan-1-one bromide

Systemtic Name: 1-(thian-1-ium-2-yl)butan-1-one bromide Openeye Name: 1-tetrahydrothiopyran-1-ium-2-ylbutan-1-one bromide CAS Name: 1-(2-thian-1-iumyl)-1-butanone bromide IUPAC Name: 1-(thian-1-ium-2-yl)butan-1-one bromide Traditional Name: 1-tetrahydrothiopyran-1-ium-2-ylbutan-1-one bromide Formula: C9H17BrOS MolecularWeight: 253.19968

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1CCCC[SH+]1.[Br-]

Isomeric SMILES

CCCC(=O)C1CCCC[SH+]1.[Br-]

InChI

InChI=1S/C9H16OS.BrH/c1-2-5-8(10)9-6-3-4-7-11-9;/h9H,2-7H2,1H3;1H