N-(4-bromanyl-2-nitro-phenyl)-1-azabicyclo[2.2.2]octan-3-amine

Systemtic Name: N-(4-bromanyl-2-nitro-phenyl)-1-azabicyclo[2.2.2]octan-3-amine Openeye Name: N-(4-bromo-2-nitro-phenyl)quinuclidin-3-amine CAS Name: N-(4-bromo-2-nitrophenyl)-1-azabicyclo[2.2.2]octan-3-amine IUPAC Name: N-(4-bromo-2-nitrophenyl)-1-azabicyclo[2.2.2]octan-3-amine Traditional Name: (4-bromo-2-nitro-phenyl)-quinuclidin-3-yl-amine Formula: C13H16BrN3O2 MolecularWeight: 326.18904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)NC3=C(C=C(C=C3)Br)[N+](=O)[O-]

Isomeric SMILES

C1CN2CCC1C(C2)NC3=C(C=C(C=C3)Br)[N+](=O)[O-]

InChI

InChI=1S/C13H16BrN3O2/c14-10-1-2-11(13(7-10)17(18)19)15-12-8-16-5-3-9(12)4-6-16/h1-2,7,9,12,15H,3-6,8H2