1-azabicyclo[2.2.2]octan-3-yl 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate hydrochloride

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate hydrochloride Openeye Name: quinuclidin-3-yl 2-cyclopentyl-2-hydroxy-2-phenyl-acetate hydrochloride CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid 1-azabicyclo[2.2.2]octan-3-yl ester hydrochloride IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 2-cyclopentyl-2-hydroxy-2-phenylacetate hydrochloride Traditional Name: 2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid quinuclidin-3-yl ester hydrochloride Formula: C20H28ClNO3 MolecularWeight: 365.89422

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OC3CN4CCC3CC4)O.Cl

Isomeric SMILES

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OC3CN4CCC3CC4)O.Cl

InChI

InChI=1S/C20H27NO3.ClH/c22-19(24-18-14-21-12-10-15(18)11-13-21)20(23,17-8-4-5-9-17)16-6-2-1-3-7-16;/h1-3,6-7,15,17-18,23H,4-5,8-14H2;1H