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1-hexylsulfanylbutyl-dimethyl-octadecyl-azanium

1-hexylsulfanylbutyl-dimethyl-octadecyl-azanium

Systemtic Name:1-hexylsulfanylbutyl-dimethyl-octadecyl-azanium
Openeye Name:1-hexylsulfanylbutyl-dimethyl-octadecyl-ammonium
CAS Name:1-(hexylthio)butyl-dimethyl-octadecylammonium
IUPAC Name:1-hexylsulfanylbutyl-dimethyl-octadecylazanium
Traditional Name:1-(hexylthio)butyl-dimethyl-stearyl-ammonium
Formula: C30H64NS+
MolecularWeight: 470.90086
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)C(CCC)SCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)C(CCC)SCCCCCC


InChI

InChI=1S/C30H64NS/c1-6-9-11-13-14-15-16-17-18-19-20-21-22-23-24-25-28-31(4,5)30(27-8-3)32-29-26-12-10-7-2/h30H,6-29H2,1-5H3/q+1


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