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1-decylsulfanylhexyl-hexadecyl-dimethyl-azanium

1-decylsulfanylhexyl-hexadecyl-dimethyl-azanium

Systemtic Name:1-decylsulfanylhexyl-hexadecyl-dimethyl-azanium
Openeye Name:1-decylsulfanylhexyl-hexadecyl-dimethyl-ammonium
CAS Name:1-(decylthio)hexyl-hexadecyl-dimethylammonium
IUPAC Name:1-decylsulfanylhexyl-hexadecyl-dimethylazanium
Traditional Name:cetyl-[1-(decylthio)hexyl]-dimethyl-ammonium
Formula: C34H72NS+
MolecularWeight: 527.00718
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(C)C(CCCCC)SCCCCCCCCCC


Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(C)C(CCCCC)SCCCCCCCCCC


InChI

InChI=1S/C34H72NS/c1-6-9-12-14-16-18-19-20-21-22-23-24-26-29-32-35(4,5)34(31-28-11-8-3)36-33-30-27-25-17-15-13-10-7-2/h34H,6-33H2,1-5H3/q+1


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