4-hexadecyl-1-aza-4-azoniabicyclo[2.2.2]octane bromide

Systemtic Name: 4-hexadecyl-1-aza-4-azoniabicyclo[2.2.2]octane bromide Openeye Name: 4-hexadecyl-1-aza-4-azoniabicyclo[2.2.2]octane bromide CAS Name: 4-hexadecyl-1-aza-4-azoniabicyclo[2.2.2]octane bromide IUPAC Name: 4-hexadecyl-1-aza-4-azoniabicyclo[2.2.2]octane bromide Traditional Name: 4-cetyl-1-aza-4-azoniabicyclo[2.2.2]octane bromide Formula: C22H45BrN2 MolecularWeight: 417.5101

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC[N+]12CCN(CC1)CC2.[Br-]

Isomeric SMILES

CCCCCCCCCCCCCCCC[N+]12CCN(CC1)CC2.[Br-]

InChI

InChI=1S/C22H45N2.BrH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-19-24-20-16-23(17-21-24)18-22-24;/h2-22H2,1H3;1H/q+1;/p-1