[(3R)-1-azabicyclo[2.2.2]octan-3-yl] 9-methylxanthene-9-carboxylate; ethanedioic acid

Systemtic Name: [(3R)-1-azabicyclo[2.2.2]octan-3-yl] 9-methylxanthene-9-carboxylate; ethanedioic acid Openeye Name: oxalic acid; [(3R)-quinuclidin-3-yl] 9-methylxanthene-9-carboxylate CAS Name: 9-methyl-9-xanthenecarboxylic acid [(3R)-1-azabicyclo[2.2.2]octan-3-yl] ester; oxalic acid IUPAC Name: [(3R)-1-azabicyclo[2.2.2]octan-3-yl] 9-methylxanthene-9-carboxylate; oxalic acid Traditional Name: 9-methylxanthene-9-carboxylic acid [(3R)-quinuclidin-3-yl] ester; oxalic acid Formula: C24H25NO7 MolecularWeight: 439.4578

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2OC3=CC=CC=C31)C(=O)OC4CN5CCC4CC5.C(=O)(C(=O)O)O

Isomeric SMILES

CC1(C2=CC=CC=C2OC3=CC=CC=C31)C(=O)O[C@H]4CN5CCC4CC5.C(=O)(C(=O)O)O

InChI

InChI=1S/C22H23NO3.C2H2O4/c1-22(21(24)26-20-14-23-12-10-15(20)11-13-23)16-6-2-4-8-18(16)25-19-9-5-3-7-17(19)22;3-1(4)2(5)6/h2-9,15,20H,10-14H2,1H3;(H,3,4)(H,5,6)/t20-;/m0./s1