ethyl (1S,5R)-3-ethyl-9-oxidanylidene-1-(3-oxidanylidenebutyl)-3-azabicyclo[3.3.1]nonane-5-carboxylate

Systemtic Name: ethyl (1S,5R)-3-ethyl-9-oxidanylidene-1-(3-oxidanylidenebutyl)-3-azabicyclo[3.3.1]nonane-5-carboxylate Openeye Name: ethyl (1S,5R)-3-ethyl-9-oxo-1-(3-oxobutyl)-3-azabicyclo[3.3.1]nonane-5-carboxylate CAS Name: (1S,5R)-3-ethyl-9-oxo-1-(3-oxobutyl)-3-azabicyclo[3.3.1]nonane-5-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,5R)-3-ethyl-9-oxo-1-(3-oxobutyl)-3-azabicyclo[3.3.1]nonane-5-carboxylate Traditional Name: (1S,5R)-3-ethyl-9-keto-1-(3-ketobutyl)-3-azabicyclo[3.3.1]nonane-5-carboxylic acid ethyl ester Formula: C17H27NO4 MolecularWeight: 309.40058

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CC2(CCCC(C1)(C2=O)C(=O)OCC)CCC(=O)C

Isomeric SMILES

CCN1C[C@]2(CCC[C@@](C1)(C2=O)C(=O)OCC)CCC(=O)C

InChI

InChI=1S/C17H27NO4/c1-4-18-11-16(10-7-13(3)19)8-6-9-17(12-18,14(16)20)15(21)22-5-2/h4-12H2,1-3H3/t16-,17+/m0/s1