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1-(didecylamino)ethyl-hexadecyl-dimethyl-azanium bromide

1-(didecylamino)ethyl-hexadecyl-dimethyl-azanium bromide

Systemtic Name:1-(didecylamino)ethyl-hexadecyl-dimethyl-azanium bromide
Openeye Name:1-(didecylamino)ethyl-hexadecyl-dimethyl-ammonium bromide
CAS Name:1-(didecylamino)ethyl-hexadecyl-dimethylammonium bromide
IUPAC Name:1-(didecylamino)ethyl-hexadecyl-dimethylazanium bromide
Traditional Name:cetyl-[1-(didecylamino)ethyl]-dimethyl-ammonium bromide
Formula: C40H85BrN2
MolecularWeight: 674.0203
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C40H85N2.BrH/c1-7-10-13-16-19-22-23-24-25-26-27-30-33-36-39-42(5,6)40(4)41(37-34-31-28-20-17-14-11-8-2)38-35-32-29-21-18-15-12-9-3;/h40H,7-39H2,1-6H3;1H/q+1;/p-1


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