N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-6-oxidanylidene-1H-pyridine-3-carboxamide

Systemtic Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-6-oxidanylidene-1H-pyridine-3-carboxamide Openeye Name: 6-oxo-N-[(3R)-quinuclidin-1-ium-3-yl]-1H-pyridine-3-carboxamide CAS Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-6-oxo-1H-pyridine-3-carboxamide IUPAC Name: N-[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl]-6-oxo-1H-pyridine-3-carboxamide Traditional Name: 6-keto-N-[(3R)-quinuclidin-1-ium-3-yl]-1H-pyridine-3-carboxamide Formula: C13H18N3O2+ MolecularWeight: 248.30092

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)NC(=O)C3=CNC(=O)C=C3

Isomeric SMILES

C1C[NH+]2CCC1[C@H](C2)NC(=O)C3=CNC(=O)C=C3

InChI

InChI=1S/C13H17N3O2/c17-12-2-1-10(7-14-12)13(18)15-11-8-16-5-3-9(11)4-6-16/h1-2,7,9,11H,3-6,8H2,(H,14,17)(H,15,18)/p+1/t11-/m0/s1