1-azabicyclo[2.2.2]octan-3-yl 2-(1-oxidanylcyclopentyl)-2-phenyl-ethanoate hydrochloride

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

Click to see the large picture

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(24-17-14-21-12-8-15(17)9-13-21)18(16-6-2-1-3-7-16)20(23)10-4-5-11-20;/h1-3,6-7,15,17-18,23H,4-5,8-14H2;1H