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heptatriacontan-19-yl(dimethyl)azanium bromide

heptatriacontan-19-yl(dimethyl)azanium bromide

Systemtic Name:heptatriacontan-19-yl(dimethyl)azanium bromide
Openeye Name:dimethyl(1-octadecylnonadecyl)ammonium bromide
CAS Name:heptatriacontan-19-yl(dimethyl)ammonium bromide
IUPAC Name:heptatriacontan-19-yl(dimethyl)azanium bromide
Traditional Name:dimethyl(1-stearylnonadecyl)ammonium bromide
Formula: C39H82BrN
MolecularWeight: 644.97908
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC)[NH+](C)C.[Br-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCCC(CCCCCCCCCCCCCCCCCC)[NH+](C)C.[Br-]


InChI

InChI=1S/C39H81N.BrH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-39(40(3)4)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h39H,5-38H2,1-4H3;1H


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