[(2E)-2-(1-azabicyclo[2.2.2]octan-3-ylidene)ethyl] 3-methyl-2-oxidanyl-2-phenyl-butanoate

Systemtic Name: [(2E)-2-(1-azabicyclo[2.2.2]octan-3-ylidene)ethyl] 3-methyl-2-oxidanyl-2-phenyl-butanoate Openeye Name: [(2E)-2-quinuclidin-3-ylideneethyl] 2-hydroxy-3-methyl-2-phenyl-butanoate CAS Name: 2-hydroxy-3-methyl-2-phenylbutanoic acid [(2E)-2-(1-azabicyclo[2.2.2]octan-3-ylidene)ethyl] ester IUPAC Name: [(2E)-2-(1-azabicyclo[2.2.2]octan-3-ylidene)ethyl] 2-hydroxy-3-methyl-2-phenylbutanoate Traditional Name: 2-hydroxy-3-methyl-2-phenyl-butyric acid [(2E)-2-quinuclidin-3-ylideneethyl] ester Formula: C20H27NO3 MolecularWeight: 329.43328

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C1=CC=CC=C1)(C(=O)OCC=C2CN3CCC2CC3)O

Isomeric SMILES

CC(C)C(C1=CC=CC=C1)(C(=O)OC/C=C\2/CN3CCC2CC3)O

InChI

InChI=1S/C20H27NO3/c1-15(2)20(23,18-6-4-3-5-7-18)19(22)24-13-10-17-14-21-11-8-16(17)9-12-21/h3-7,10,15-16,23H,8-9,11-14H2,1-2H3/b17-10-