4-[(3-bromophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane chloride

Systemtic Name: 4-[(3-bromophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane chloride Openeye Name: 4-[(3-bromophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane chloride CAS Name: 4-[(3-bromophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane chloride IUPAC Name: 4-[(3-bromophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane chloride Traditional Name: 4-(3-bromobenzyl)-1-aza-4-azoniabicyclo[2.2.2]octane chloride Formula: C13H18BrClN2 MolecularWeight: 317.65242

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCN1CC2)CC3=CC(=CC=C3)Br.[Cl-]

Isomeric SMILES

C1C[N+]2(CCN1CC2)CC3=CC(=CC=C3)Br.[Cl-]

InChI

InChI=1S/C13H18BrN2.ClH/c14-13-3-1-2-12(10-13)11-16-7-4-15(5-8-16)6-9-16;/h1-3,10H,4-9,11H2;1H/q+1;/p-1