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hexadecyl-methyl-dioctadecyl-azanium chloride

hexadecyl-methyl-dioctadecyl-azanium chloride

Systemtic Name:hexadecyl-methyl-dioctadecyl-azanium chloride
Openeye Name:hexadecyl-methyl-dioctadecyl-ammonium chloride
CAS Name:hexadecyl-methyl-dioctadecylammonium chloride
IUPAC Name:hexadecyl-methyl-dioctadecylazanium chloride
Traditional Name:cetyl-methyl-distearyl-ammonium chloride
Formula: C53H110ClN
MolecularWeight: 796.9002
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC.[Cl-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCCCC.[Cl-]


InChI

InChI=1S/C53H110N.ClH/c1-5-8-11-14-17-20-23-26-29-31-34-37-40-43-46-49-52-54(4,51-48-45-42-39-36-33-28-25-22-19-16-13-10-7-3)53-50-47-44-41-38-35-32-30-27-24-21-18-15-12-9-6-2;/h5-53H2,1-4H3;1H/q+1;/p-1


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