1-(3-methoxypentyl)-1-azoniabicyclo[2.2.2]octane bromide

Systemtic Name: 1-(3-methoxypentyl)-1-azoniabicyclo[2.2.2]octane bromide Openeye Name: 1-(3-methoxypentyl)quinuclidin-1-ium bromide CAS Name: 1-(3-methoxypentyl)-1-azoniabicyclo[2.2.2]octane bromide IUPAC Name: 1-(3-methoxypentyl)-1-azoniabicyclo[2.2.2]octane bromide Traditional Name: 1-(3-methoxypentyl)quinuclidin-1-ium bromide Formula: C13H26BrNO MolecularWeight: 292.25564

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC[N+]12CCC(CC1)CC2)OC.[Br-]

Isomeric SMILES

CCC(CC[N+]12CCC(CC1)CC2)OC.[Br-]

InChI

InChI=1S/C13H26NO.BrH/c1-3-13(15-2)7-11-14-8-4-12(5-9-14)6-10-14;/h12-13H,3-11H2,1-2H3;1H/q+1;/p-1