tris(2-methylpropyl)-(8-methylsulfonylsulfanyloctyl)azanium bromide

Systemtic Name: tris(2-methylpropyl)-(8-methylsulfonylsulfanyloctyl)azanium bromide Openeye Name: triisobutyl(8-methylsulfonylsulfanyloctyl)ammonium bromide CAS Name: tris(2-methylpropyl)-[8-(methylsulfonylthio)octyl]ammonium bromide IUPAC Name: tris(2-methylpropyl)-(8-methylsulfonylsulfanyloctyl)azanium bromide Traditional Name: triisobutyl-[8-(mesylthio)octyl]ammonium bromide Formula: C21H46BrNO2S2 MolecularWeight: 488.62944

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C[N+](CCCCCCCCSS(=O)(=O)C)(CC(C)C)CC(C)C.[Br-]

Isomeric SMILES

CC(C)C[N+](CCCCCCCCSS(=O)(=O)C)(CC(C)C)CC(C)C.[Br-]

InChI

InChI=1S/C21H46NO2S2.BrH/c1-19(2)16-22(17-20(3)4,18-21(5)6)14-12-10-8-9-11-13-15-25-26(7,23)24;/h19-21H,8-18H2,1-7H3;1H/q+1;/p-1