1-butyl-2,2,6,6-tetramethyl-1-azoniabicyclo[2.2.2]octane bromide

Systemtic Name: 1-butyl-2,2,6,6-tetramethyl-1-azoniabicyclo[2.2.2]octane bromide Openeye Name: 1-butyl-2,2,6,6-tetramethyl-quinuclidin-1-ium bromide CAS Name: 1-butyl-2,2,6,6-tetramethyl-1-azoniabicyclo[2.2.2]octane bromide IUPAC Name: 1-butyl-2,2,6,6-tetramethyl-1-azoniabicyclo[2.2.2]octane bromide Traditional Name: 1-butyl-2,2,6,6-tetramethyl-quinuclidin-1-ium bromide Formula: C15H30BrN MolecularWeight: 304.3094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC[N+]12CCC(CC1(C)C)CC2(C)C.[Br-]

Isomeric SMILES

CCCC[N+]12CCC(CC1(C)C)CC2(C)C.[Br-]

InChI

InChI=1S/C15H30N.BrH/c1-6-7-9-16-10-8-13(11-14(16,2)3)12-15(16,4)5;/h13H,6-12H2,1-5H3;1H/q+1;/p-1