[9-(phenylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl] 2-oxidanyl-2,2-diphenyl-ethanoate

Systemtic Name: [9-(phenylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl] 2-oxidanyl-2,2-diphenyl-ethanoate Openeye Name: (9-benzyl-9-azabicyclo[3.3.1]nonan-3-yl) 2-hydroxy-2,2-diphenyl-acetate CAS Name: 2-hydroxy-2,2-diphenylacetic acid [9-(phenylmethyl)-9-azabicyclo[3.3.1]nonan-3-yl] ester IUPAC Name: (9-benzyl-9-azabicyclo[3.3.1]nonan-3-yl) 2-hydroxy-2,2-diphenylacetate Traditional Name: 2-hydroxy-2,2-diphenyl-acetic acid (9-benzyl-9-azabicyclo[3.3.1]nonan-3-yl) ester Formula: C29H31NO3 MolecularWeight: 441.56134

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2CC(CC(C1)N2CC3=CC=CC=C3)OC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O

Isomeric SMILES

C1CC2CC(CC(C1)N2CC3=CC=CC=C3)OC(=O)C(C4=CC=CC=C4)(C5=CC=CC=C5)O

InChI

InChI=1S/C29H31NO3/c31-28(29(32,23-13-6-2-7-14-23)24-15-8-3-9-16-24)33-27-19-25-17-10-18-26(20-27)30(25)21-22-11-4-1-5-12-22/h1-9,11-16,25-27,32H,10,17-21H2