1-azabicyclo[2.2.2]octan-3-yl 3-(4-methoxyphenyl)-2-phenyl-propanoate hydrochloride

Systemtic Name: 1-azabicyclo[2.2.2]octan-3-yl 3-(4-methoxyphenyl)-2-phenyl-propanoate hydrochloride Openeye Name: quinuclidin-3-yl 3-(4-methoxyphenyl)-2-phenyl-propanoate hydrochloride CAS Name: 3-(4-methoxyphenyl)-2-phenylpropanoic acid 1-azabicyclo[2.2.2]octan-3-yl ester hydrochloride IUPAC Name: 1-azabicyclo[2.2.2]octan-3-yl 3-(4-methoxyphenyl)-2-phenylpropanoate hydrochloride Traditional Name: 3-(4-methoxyphenyl)-2-phenyl-propionic acid quinuclidin-3-yl ester hydrochloride Formula: C23H28ClNO3 MolecularWeight: 401.92632

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CC(C2=CC=CC=C2)C(=O)OC3CN4CCC3CC4.Cl

Isomeric SMILES

COC1=CC=C(C=C1)CC(C2=CC=CC=C2)C(=O)OC3CN4CCC3CC4.Cl

InChI

InChI=1S/C23H27NO3.ClH/c1-26-20-9-7-17(8-10-20)15-21(18-5-3-2-4-6-18)23(25)27-22-16-24-13-11-19(22)12-14-24;/h2-10,19,21-22H,11-16H2,1H3;1H