phenyl N-[(2S,3S)-2-(diphenylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]carbamate

Systemtic Name: phenyl N-[(2S,3S)-2-(diphenylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]carbamate Openeye Name: phenyl N-[(2S,3S)-2-benzhydrylquinuclidin-3-yl]carbamate CAS Name: N-[(2S,3S)-2-(diphenylmethyl)-1-azabicyclo[2.2.2]octan-3-yl]carbamic acid phenyl ester IUPAC Name: phenyl N-[(2S,3S)-2-benzhydryl-1-azabicyclo[2.2.2]octan-3-yl]carbamate Traditional Name: N-[(2S,3S)-2-benzhydrylquinuclidin-3-yl]carbamic acid phenyl ester Formula: C27H28N2O2 MolecularWeight: 412.52342

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2C(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)OC5=CC=CC=C5

Isomeric SMILES

C1CN2CCC1[C@@H]([C@@H]2C(C3=CC=CC=C3)C4=CC=CC=C4)NC(=O)OC5=CC=CC=C5

InChI

InChI=1S/C27H28N2O2/c30-27(31-23-14-8-3-9-15-23)28-25-22-16-18-29(19-17-22)26(25)24(20-10-4-1-5-11-20)21-12-6-2-7-13-21/h1-15,22,24-26H,16-19H2,(H,28,30)/t25-,26-/m0/s1