[(3R)-1-azoniabicyclo[2.2.2]octan-3-yl] adamantane-1-carboxylate

Systemtic Name: [(3R)-1-azoniabicyclo[2.2.2]octan-3-yl] adamantane-1-carboxylate Openeye Name: [(3R)-quinuclidin-1-ium-3-yl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [(3R)-1-azoniabicyclo[2.2.2]octan-3-yl] ester IUPAC Name: [(3R)-1-azoniabicyclo[2.2.2]octan-3-yl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [(3R)-quinuclidin-1-ium-3-yl] ester Formula: C18H28NO2+ MolecularWeight: 290.42042

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+]2CCC1C(C2)OC(=O)C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1C[NH+]2CCC1[C@H](C2)OC(=O)C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C18H27NO2/c20-17(21-16-11-19-3-1-15(16)2-4-19)18-8-12-5-13(9-18)7-14(6-12)10-18/h12-16H,1-11H2/p+1/t12?,13?,14?,16-,18?/m0/s1