[(2E)-2-(1-azabicyclo[2.2.2]octan-3-ylidene)ethyl] 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [(2E)-2-(1-azabicyclo[2.2.2]octan-3-ylidene)ethyl] 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: [(2E)-2-quinuclidin-3-ylideneethyl] 2-cyclopentyl-2-hydroxy-2-phenyl-acetate CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid [(2E)-2-(1-azabicyclo[2.2.2]octan-3-ylidene)ethyl] ester IUPAC Name: [(2E)-2-(1-azabicyclo[2.2.2]octan-3-ylidene)ethyl] 2-cyclopentyl-2-hydroxy-2-phenylacetate Traditional Name: 2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid [(2E)-2-quinuclidin-3-ylideneethyl] ester Formula: C22H29NO3 MolecularWeight: 355.47056

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OCC=C3CN4CCC3CC4)O

Isomeric SMILES

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OC/C=C\3/CN4CCC3CC4)O

InChI

InChI=1S/C22H29NO3/c24-21(26-15-12-18-16-23-13-10-17(18)11-14-23)22(25,20-8-4-5-9-20)19-6-2-1-3-7-19/h1-3,6-7,12,17,20,25H,4-5,8-11,13-16H2/b18-12-