2-(diphenylmethyl)-3-phenylmethoxy-1-azabicyclo[2.2.2]octane; ethanedioic acid

Systemtic Name: 2-(diphenylmethyl)-3-phenylmethoxy-1-azabicyclo[2.2.2]octane; ethanedioic acid Openeye Name: 2-benzhydryl-3-benzyloxy-quinuclidine; oxalic acid CAS Name: 2-(diphenylmethyl)-3-phenylmethoxy-1-azabicyclo[2.2.2]octane; oxalic acid IUPAC Name: 2-benzhydryl-3-phenylmethoxy-1-azabicyclo[2.2.2]octane; oxalic acid Traditional Name: 2-benzhydryl-3-benzoxy-quinuclidine; oxalic acid Formula: C29H31NO5 MolecularWeight: 473.56014

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Descriptors Computed from Structure

Canonical SMILES:

C1CN2CCC1C(C2C(C3=CC=CC=C3)C4=CC=CC=C4)OCC5=CC=CC=C5.C(=O)(C(=O)O)O

Isomeric SMILES

C1CN2CCC1C(C2C(C3=CC=CC=C3)C4=CC=CC=C4)OCC5=CC=CC=C5.C(=O)(C(=O)O)O

InChI

InChI=1S/C27H29NO.C2H2O4/c1-4-10-21(11-5-1)20-29-27-24-16-18-28(19-17-24)26(27)25(22-12-6-2-7-13-22)23-14-8-3-9-15-23;3-1(4)2(5)6/h1-15,24-27H,16-20H2;(H,3,4)(H,5,6)