1-(phenylmethyl)-1-azoniabicyclo[2.2.2]octane bromide

Systemtic Name: 1-(phenylmethyl)-1-azoniabicyclo[2.2.2]octane bromide Openeye Name: 1-benzylquinuclidin-1-ium bromide CAS Name: 1-(phenylmethyl)-1-azoniabicyclo[2.2.2]octane bromide IUPAC Name: 1-benzyl-1-azoniabicyclo[2.2.2]octane bromide Traditional Name: 1-benzylquinuclidin-1-ium bromide Formula: C14H20BrN MolecularWeight: 282.2193

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1CC2)CC3=CC=CC=C3.[Br-]

Isomeric SMILES

C1C[N+]2(CCC1CC2)CC3=CC=CC=C3.[Br-]

InChI

InChI=1S/C14H20N.BrH/c1-2-4-14(5-3-1)12-15-9-6-13(7-10-15)8-11-15;/h1-5,13H,6-12H2;1H/q+1;/p-1