(2R)-2-(1,3-benzodioxol-5-ylmethyl)-1-azoniabicyclo[2.2.2]octan-3-one

Systemtic Name: (2R)-2-(1,3-benzodioxol-5-ylmethyl)-1-azoniabicyclo[2.2.2]octan-3-one Openeye Name: (2R)-2-(1,3-benzodioxol-5-ylmethyl)quinuclidin-1-ium-3-one CAS Name: (2R)-2-(1,3-benzodioxol-5-ylmethyl)-1-azoniabicyclo[2.2.2]octan-3-one IUPAC Name: (2R)-2-(1,3-benzodioxol-5-ylmethyl)-1-azoniabicyclo[2.2.2]octan-3-one Traditional Name: (2R)-2-piperonylquinuclidin-1-ium-3-one Formula: C15H18NO3+ MolecularWeight: 260.30832

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(=O)C2CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1C[NH+]2CCC1C(=O)[C@H]2CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C15H17NO3/c17-15-11-3-5-16(6-4-11)12(15)7-10-1-2-13-14(8-10)19-9-18-13/h1-2,8,11-12H,3-7,9H2/p+1/t12-/m1/s1