[3-(phenylmethyl)-3-azabicyclo[3.2.1]octan-8-yl] 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate

Systemtic Name: [3-(phenylmethyl)-3-azabicyclo[3.2.1]octan-8-yl] 2-cyclopentyl-2-oxidanyl-2-phenyl-ethanoate Openeye Name: (3-benzyl-3-azabicyclo[3.2.1]octan-8-yl) 2-cyclopentyl-2-hydroxy-2-phenyl-acetate CAS Name: 2-cyclopentyl-2-hydroxy-2-phenylacetic acid [3-(phenylmethyl)-3-azabicyclo[3.2.1]octan-8-yl] ester IUPAC Name: (3-benzyl-3-azabicyclo[3.2.1]octan-8-yl) 2-cyclopentyl-2-hydroxy-2-phenylacetate Traditional Name: 2-cyclopentyl-2-hydroxy-2-phenyl-acetic acid (3-benzyl-3-azabicyclo[3.2.1]octan-8-yl) ester Formula: C27H33NO3 MolecularWeight: 419.55582

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OC3C4CCC3CN(C4)CC5=CC=CC=C5)O

Isomeric SMILES

C1CCC(C1)C(C2=CC=CC=C2)(C(=O)OC3C4CCC3CN(C4)CC5=CC=CC=C5)O

InChI

InChI=1S/C27H33NO3/c29-26(27(30,24-13-7-8-14-24)23-11-5-2-6-12-23)31-25-21-15-16-22(25)19-28(18-21)17-20-9-3-1-4-10-20/h1-6,9-12,21-22,24-25,30H,7-8,13-19H2