tert-butyl 4-(1-azabicyclo[2.2.2]octan-3-yloxycarbonylamino)-4-phenyl-piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-(1-azabicyclo[2.2.2]octan-3-yloxycarbonylamino)-4-phenyl-piperidine-1-carboxylate Openeye Name: tert-butyl 4-phenyl-4-(quinuclidin-3-yloxycarbonylamino)piperidine-1-carboxylate CAS Name: 4-[[1-azabicyclo[2.2.2]octan-3-yloxy(oxo)methyl]amino]-4-phenyl-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-(1-azabicyclo[2.2.2]octan-3-yloxycarbonylamino)-4-phenylpiperidine-1-carboxylate Traditional Name: 4-phenyl-4-(quinuclidin-3-yloxycarbonylamino)piperidine-1-carboxylic acid tert-butyl ester Formula: C24H35N3O4 MolecularWeight: 429.5524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)(C2=CC=CC=C2)NC(=O)OC3CN4CCC3CC4

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)(C2=CC=CC=C2)NC(=O)OC3CN4CCC3CC4

InChI

InChI=1S/C24H35N3O4/c1-23(2,3)31-22(29)27-15-11-24(12-16-27,19-7-5-4-6-8-19)25-21(28)30-20-17-26-13-9-18(20)10-14-26/h4-8,18,20H,9-17H2,1-3H3,(H,25,28)