4-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane

Systemtic Name: 4-[(4-bromanyl-2-fluoranyl-phenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane Openeye Name: 4-[(4-bromo-2-fluoro-phenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane CAS Name: 4-[(4-bromo-2-fluorophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane IUPAC Name: 4-[(4-bromo-2-fluorophenyl)methyl]-1-aza-4-azoniabicyclo[2.2.2]octane Traditional Name: 4-(4-bromo-2-fluoro-benzyl)-1-aza-4-azoniabicyclo[2.2.2]octane Formula: C13H17BrFN2+ MolecularWeight: 300.189883

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCN1CC2)CC3=C(C=C(C=C3)Br)F

Isomeric SMILES

C1C[N+]2(CCN1CC2)CC3=C(C=C(C=C3)Br)F

InChI

InChI=1S/C13H17BrFN2/c14-12-2-1-11(13(15)9-12)10-17-6-3-16(4-7-17)5-8-17/h1-2,9H,3-8,10H2/q+1