1-[(2-nitrophenyl)methyl]-1-azoniabicyclo[2.2.2]octane

Systemtic Name: 1-[(2-nitrophenyl)methyl]-1-azoniabicyclo[2.2.2]octane Openeye Name: 1-[(2-nitrophenyl)methyl]quinuclidin-1-ium CAS Name: 1-[(2-nitrophenyl)methyl]-1-azoniabicyclo[2.2.2]octane IUPAC Name: 1-[(2-nitrophenyl)methyl]-1-azoniabicyclo[2.2.2]octane Traditional Name: 1-(2-nitrobenzyl)quinuclidin-1-ium Formula: C14H19N2O2+ MolecularWeight: 247.31286

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H19N2O2/c17-15(18)14-4-2-1-3-13(14)11-16-8-5-12(6-9-16)7-10-16/h1-4,12H,5-11H2/q+1