hexadecyl(trioctadecyl)azanium chloride

Systemtic Name: hexadecyl(trioctadecyl)azanium chloride Openeye Name: hexadecyl(trioctadecyl)ammonium chloride CAS Name: hexadecyl(trioctadecyl)ammonium chloride IUPAC Name: hexadecyl(trioctadecyl)azanium chloride Traditional Name: cetyl(tristearyl)ammonium chloride Formula: C70H144ClN MolecularWeight: 1035.35206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C70H144N.ClH/c1-5-9-13-17-21-25-29-33-37-40-44-48-52-56-60-64-68-71(67-63-59-55-51-47-43-36-32-28-24-20-16-12-8-4,69-65-61-57-53-49-45-41-38-34-30-26-22-18-14-10-6-2)70-66-62-58-54-50-46-42-39-35-31-27-23-19-15-11-7-3;/h5-70H2,1-4H3;1H/q+1;/p-1