1-azabicyclo[2.2.2]octan-3-yl 2-cyclohex-2-en-1-yl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl 2-cyclohex-2-en-1-yl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: quinuclidin-3-yl 2-cyclohex-2-en-1-yl-2-hydroxy-2-phenyl-acetate CAS Name: 2-(1-cyclohex-2-enyl)-2-hydroxy-2-phenylacetic acid 1-azabicyclo[2.2.2]octan-3-yl ester IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 2-cyclohex-2-en-1-yl-2-hydroxy-2-phenylacetate Traditional Name: 2-cyclohex-2-en-1-yl-2-hydroxy-2-phenyl-acetic acid quinuclidin-3-yl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

C1CC=CC(C1)C(C2=CC=CC=C2)(C(=O)OC3CN4CCC3CC4)O

Isomeric SMILES

C1CC=CC(C1)C(C2=CC=CC=C2)(C(=O)OC3CN4CCC3CC4)O

InChI

InChI=1S/C21H27NO3/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/h1,3-5,7-9,16,18-19,24H,2,6,10-15H2