(2-methylidene-1-azabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: (2-methylidene-1-azabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: (2-methylenequinuclidin-3-yl) 2-cyclopentyl-2-hydroxy-2-phenyl-acetate CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid (2-methylene-1-azabicyclo[2.2.2]octan-3-yl) ester IUPAC Name: (2-methylidene-1-azabicyclo[2.2.2]octan-3-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate Traditional Name: 2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid (2-methylenequinuclidin-3-yl) ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C(C2CCN1CC2)OC(=O)C(C3CCCC3)(C4=CC=CC=C4)O

Isomeric SMILES

C=C1C(C2CCN1CC2)OC(=O)C(C3CCCC3)(C4=CC=CC=C4)O

InChI

InChI=1S/C21H27NO3/c1-15-19(16-11-13-22(15)14-12-16)25-20(23)21(24,18-9-5-6-10-18)17-7-3-2-4-8-17/h2-4,7-8,16,18-19,24H,1,5-6,9-14H2