[3-(phenylmethyl)-3-azabicyclo[3.2.1]octan-8-yl] 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: [3-(phenylmethyl)-3-azabicyclo[3.2.1]octan-8-yl] 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: (3-benzyl-3-azabicyclo[3.2.1]octan-8-yl) 2-hydroxy-2,2-diphenyl-acetate CAS Name: 2-hydroxy-2,2-diphenylacetic 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-hydroxy-2,2-diphenylacetate Traditional Name: 2-hydroxy-2,2-diphenyl-acetic acid (3-benzyl-3-azabicyclo[3.2.1]octan-8-yl) ester Formula: C28H29NO3 MolecularWeight: 427.53476

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CN(CC1C2OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)CC5=CC=CC=C5

Isomeric SMILES

C1CC2CN(CC1C2OC(=O)C(C3=CC=CC=C3)(C4=CC=CC=C4)O)CC5=CC=CC=C5

InChI

InChI=1S/C28H29NO3/c30-27(28(31,24-12-6-2-7-13-24)25-14-8-3-9-15-25)32-26-22-16-17-23(26)20-29(19-22)18-21-10-4-1-5-11-21/h1-15,22-23,26,31H,16-20H2