(1S,6R)-9-(pyridin-3-ylmethyl)-4-aza-9-azoniabicyclo[4.2.1]nonan-3-one

Systemtic Name: (1S,6R)-9-(pyridin-3-ylmethyl)-4-aza-9-azoniabicyclo[4.2.1]nonan-3-one Openeye Name: (1S,6R)-9-(3-pyridylmethyl)-4-aza-9-azoniabicyclo[4.2.1]nonan-3-one CAS Name: (1S,6R)-9-(3-pyridinylmethyl)-4-aza-9-azoniabicyclo[4.2.1]nonan-3-one IUPAC Name: (1S,6R)-9-(pyridin-3-ylmethyl)-4-aza-9-azoniabicyclo[4.2.1]nonan-3-one Traditional Name: (1S,6R)-9-(3-pyridylmethyl)-4-aza-9-azoniabicyclo[4.2.1]nonan-3-one Formula: C13H18N3O+ MolecularWeight: 232.30152

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CNC(=O)CC1[NH+]2CC3=CN=CC=C3

Isomeric SMILES

C1C[C@@H]2CNC(=O)C[C@H]1[NH+]2CC3=CN=CC=C3

InChI

InChI=1S/C13H17N3O/c17-13-6-11-3-4-12(8-15-13)16(11)9-10-2-1-5-14-7-10/h1-2,5,7,11-12H,3-4,6,8-9H2,(H,15,17)/p+1/t11-,12+/m0/s1