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tri(heptadecan-2-yl)azanium bromide

tri(heptadecan-2-yl)azanium bromide

Systemtic Name:tri(heptadecan-2-yl)azanium bromide
Openeye Name:tris(1-methylhexadecyl)ammonium bromide
CAS Name:tri(heptadecan-2-yl)ammonium bromide
IUPAC Name:tri(heptadecan-2-yl)azanium bromide
Traditional Name:tris(1-methylhexadecyl)ammonium bromide
Formula: C51H106BrN
MolecularWeight: 813.29804
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(C)[NH+](C(C)CCCCCCCCCCCCCCC)C(C)CCCCCCCCCCCCCCC.[Br-]


Isomeric SMILES

CCCCCCCCCCCCCCCC(C)[NH+](C(C)CCCCCCCCCCCCCCC)C(C)CCCCCCCCCCCCCCC.[Br-]


InChI

InChI=1S/C51H105N.BrH/c1-7-10-13-16-19-22-25-28-31-34-37-40-43-46-49(4)52(50(5)47-44-41-38-35-32-29-26-23-20-17-14-11-8-2)51(6)48-45-42-39-36-33-30-27-24-21-18-15-12-9-3;/h49-51H,7-48H2,1-6H3;1H


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