butylsulfanylmethyl-dodecyl-dimethyl-azanium bromide

Systemtic Name: butylsulfanylmethyl-dodecyl-dimethyl-azanium bromide Openeye Name: butylsulfanylmethyl-dodecyl-dimethyl-ammonium bromide CAS Name: (butylthio)methyl-dodecyl-dimethylammonium bromide IUPAC Name: butylsulfanylmethyl-dodecyl-dimethylazanium bromide Traditional Name: (butylthio)methyl-lauryl-dimethyl-ammonium bromide Formula: C19H42BrNS MolecularWeight: 396.51248

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCC[N+](C)(C)CSCCCC.[Br-]

Isomeric SMILES

CCCCCCCCCCCC[N+](C)(C)CSCCCC.[Br-]

InChI

InChI=1S/C19H42NS.BrH/c1-5-7-9-10-11-12-13-14-15-16-17-20(3,4)19-21-18-8-6-2;/h5-19H2,1-4H3;1H/q+1;/p-1