butylsulfanylmethyl-didodecyl-methyl-azanium chloride

Systemtic Name: butylsulfanylmethyl-didodecyl-methyl-azanium chloride Openeye Name: butylsulfanylmethyl-didodecyl-methyl-ammonium chloride CAS Name: (butylthio)methyl-didodecyl-methylammonium chloride IUPAC Name: butylsulfanylmethyl-didodecyl-methylazanium chloride Traditional Name: (butylthio)methyl-dilauryl-methyl-ammonium chloride Formula: C30H64ClNS MolecularWeight: 506.35386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C30H64NS.ClH/c1-5-8-11-13-15-17-19-21-23-25-27-31(4,30-32-29-10-7-3)28-26-24-22-20-18-16-14-12-9-6-2;/h5-30H2,1-4H3;1H/q+1;/p-1