dimethyl (2S,4S,5R)-1-azabicyclo[2.2.2]octane-2,5-dicarboxylate

Systemtic Name: dimethyl (2S,4S,5R)-1-azabicyclo[2.2.2]octane-2,5-dicarboxylate Openeye Name: dimethyl (2S,4S,5R)-quinuclidine-2,5-dicarboxylate CAS Name: (2S,4S,5R)-1-azabicyclo[2.2.2]octane-2,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,4S,5R)-1-azabicyclo[2.2.2]octane-2,5-dicarboxylate Traditional Name: (2S,4S,5R)-quinuclidine-2,5-dicarboxylic acid dimethyl ester Formula: C11H17NO4 MolecularWeight: 227.25698

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CC2CCN1CC2C(=O)OC

Isomeric SMILES

COC(=O)[C@@H]1C[C@@H]2CCN1C[C@@H]2C(=O)OC

InChI

InChI=1S/C11H17NO4/c1-15-10(13)8-6-12-4-3-7(8)5-9(12)11(14)16-2/h7-9H,3-6H2,1-2H3/t7-,8-,9-/m0/s1