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dimethyl-[3-(octadecanoylamino)propyl]-octadecyl-azanium bromide

dimethyl-[3-(octadecanoylamino)propyl]-octadecyl-azanium bromide

Systemtic Name:dimethyl-[3-(octadecanoylamino)propyl]-octadecyl-azanium bromide
Openeye Name:dimethyl-[3-(octadecanoylamino)propyl]-octadecyl-ammonium bromide
CAS Name:dimethyl-octadecyl-[3-(1-oxooctadecylamino)propyl]ammonium bromide
IUPAC Name:dimethyl-[3-(octadecanoylamino)propyl]-octadecylazanium bromide
Traditional Name:dimethyl-(3-stearamidopropyl)-stearyl-ammonium bromide
Formula: C41H85BrN2O
MolecularWeight: 702.0304
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCNC(=O)CCCCCCCCCCCCCCCCC.[Br-]


Isomeric SMILES

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCCNC(=O)CCCCCCCCCCCCCCCCC.[Br-]


InChI

InChI=1S/C41H84N2O.BrH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-43(3,4)40-36-38-42-41(44)37-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h5-40H2,1-4H3;1H


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