[(3R)-1-azabicyclo[2.2.2]octan-3-yl] (2R)-2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [(3R)-1-azabicyclo[2.2.2]octan-3-yl] (2R)-2-cyclohexyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: [(3R)-quinuclidin-3-yl] (2R)-2-cyclohexyl-2-hydroxy-2-phenyl-acetate CAS Name: (2R)-2-cyclohexyl-2-hydroxy-2-phenylacetic acid [(3R)-1-azabicyclo[2.2.2]octan-3-yl] ester IUPAC Name: [(3R)-1-azabicyclo[2.2.2]octan-3-yl] (2R)-2-cyclohexyl-2-hydroxy-2-phenylacetate Traditional Name: (2R)-2-cyclohexyl-2-hydroxy-2-phenyl-acetic acid [(3R)-quinuclidin-3-yl] ester Formula: C21H29NO3 MolecularWeight: 343.45986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(C2=CC=CC=C2)(C(=O)OC3CN4CCC3CC4)O

Isomeric SMILES

C1CCC(CC1)[C@@](C2=CC=CC=C2)(C(=O)O[C@H]3CN4CCC3CC4)O

InChI

InChI=1S/C21H29NO3/c23-20(25-19-15-22-13-11-16(19)12-14-22)21(24,17-7-3-1-4-8-17)18-9-5-2-6-10-18/h1,3-4,7-8,16,18-19,24H,2,5-6,9-15H2/t19-,21-/m0/s1