[(3R)-1-azabicyclo[2.2.2]octan-3-yl] 9H-thioxanthene-9-carboxylate

Systemtic Name: [(3R)-1-azabicyclo[2.2.2]octan-3-yl] 9H-thioxanthene-9-carboxylate Openeye Name: [(3R)-quinuclidin-3-yl] 9H-thioxanthene-9-carboxylate CAS Name: 9H-thioxanthene-9-carboxylic acid [(3R)-1-azabicyclo[2.2.2]octan-3-yl] ester IUPAC Name: [(3R)-1-azabicyclo[2.2.2]octan-3-yl] 9H-thioxanthene-9-carboxylate Traditional Name: 9H-thioxanthene-9-carboxylic acid [(3R)-quinuclidin-3-yl] ester Formula: C21H21NO2S MolecularWeight: 351.46194

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2)OC(=O)C3C4=CC=CC=C4SC5=CC=CC=C35

Isomeric SMILES

C1CN2CCC1[C@H](C2)OC(=O)C3C4=CC=CC=C4SC5=CC=CC=C35

InChI

InChI=1S/C21H21NO2S/c23-21(24-17-13-22-11-9-14(17)10-12-22)20-15-5-1-3-7-18(15)25-19-8-4-2-6-16(19)20/h1-8,14,17,20H,9-13H2/t17-/m0/s1