1-azabicyclo[2.2.2]octan-3-yl 1-phenylcyclohexane-1-carboxylate hydrochloride

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl 1-phenylcyclohexane-1-carboxylate hydrochloride Openeye Name: quinuclidin-3-yl 1-phenylcyclohexanecarboxylate hydrochloride CAS Name: 1-phenyl-1-cyclohexanecarboxylic acid 1-azabicyclo[2.2.2]octan-3-yl ester hydrochloride IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 1-phenylcyclohexane-1-carboxylate hydrochloride Traditional Name: 1-phenylcyclohexanecarboxylic acid quinuclidin-3-yl ester hydrochloride Formula: C20H28ClNO2 MolecularWeight: 349.89482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H27NO2.ClH/c22-19(23-18-15-21-13-9-16(18)10-14-21)20(11-5-2-6-12-20)17-7-3-1-4-8-17;/h1,3-4,7-8,16,18H,2,5-6,9-15H2;1H