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trihexadecyl(methyl)azanium bromide

trihexadecyl(methyl)azanium bromide

Systemtic Name:trihexadecyl(methyl)azanium bromide
Openeye Name:trihexadecyl(methyl)ammonium bromide
CAS Name:trihexadecyl(methyl)ammonium bromide
IUPAC Name:trihexadecyl(methyl)azanium bromide
Traditional Name:tricetyl(methyl)ammonium bromide
Formula: C49H102BrN
MolecularWeight: 785.24488
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC.[Br-]


Isomeric SMILES

CCCCCCCCCCCCCCCC[N+](C)(CCCCCCCCCCCCCCCC)CCCCCCCCCCCCCCCC.[Br-]


InChI

InChI=1S/C49H102N.BrH/c1-5-8-11-14-17-20-23-26-29-32-35-38-41-44-47-50(4,48-45-42-39-36-33-30-27-24-21-18-15-12-9-6-2)49-46-43-40-37-34-31-28-25-22-19-16-13-10-7-3;/h5-49H2,1-4H3;1H/q+1;/p-1


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