ethyl (1S,4R)-2-(2-ethoxy-2-oxidanylidene-ethyl)-2-azabicyclo[2.2.2]octane-5-carboxylate

Systemtic Name: ethyl (1S,4R)-2-(2-ethoxy-2-oxidanylidene-ethyl)-2-azabicyclo[2.2.2]octane-5-carboxylate Openeye Name: ethyl (1S,4R)-2-(2-ethoxy-2-oxo-ethyl)-2-azabicyclo[2.2.2]octane-5-carboxylate CAS Name: (1S,4R)-2-(2-ethoxy-2-oxoethyl)-2-azabicyclo[2.2.2]octane-5-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,4R)-2-(2-ethoxy-2-oxoethyl)-2-azabicyclo[2.2.2]octane-5-carboxylate Traditional Name: (1S,4R)-2-(2-ethoxy-2-keto-ethyl)-2-azabicyclo[2.2.2]octane-5-carboxylic acid ethyl ester Formula: C14H23NO4 MolecularWeight: 269.33672

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1CC2CCC1CC2C(=O)OCC

Isomeric SMILES

CCOC(=O)CN1C[C@@H]2CC[C@H]1CC2C(=O)OCC

InChI

InChI=1S/C14H23NO4/c1-3-18-13(16)9-15-8-10-5-6-11(15)7-12(10)14(17)19-4-2/h10-12H,3-9H2,1-2H3/t10-,11-,12?/m0/s1