1-(2-pyridin-4-ylethyl)-1-azoniabicyclo[2.2.2]octane

Systemtic Name: 1-(2-pyridin-4-ylethyl)-1-azoniabicyclo[2.2.2]octane Openeye Name: 1-[2-(4-pyridyl)ethyl]quinuclidin-1-ium CAS Name: 1-(2-pyridin-4-ylethyl)-1-azoniabicyclo[2.2.2]octane IUPAC Name: 1-(2-pyridin-4-ylethyl)-1-azoniabicyclo[2.2.2]octane Traditional Name: 1-[2-(4-pyridyl)ethyl]quinuclidin-1-ium Formula: C14H21N2+ MolecularWeight: 217.32994

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Descriptors Computed from Structure

Canonical SMILES:

C1C[N+]2(CCC1CC2)CCC3=CC=NC=C3

Isomeric SMILES

C1C[N+]2(CCC1CC2)CCC3=CC=NC=C3

InChI

InChI=1S/C14H21N2/c1-7-15-8-2-13(1)3-9-16-10-4-14(5-11-16)6-12-16/h1-2,7-8,14H,3-6,9-12H2/q+1