ethyl (1S,2S,3S,4R)-3-iodanyl-2-oxidanyl-5-azabicyclo[2.2.0]hexane-5-carboxylate

Systemtic Name: ethyl (1S,2S,3S,4R)-3-iodanyl-2-oxidanyl-5-azabicyclo[2.2.0]hexane-5-carboxylate Openeye Name: ethyl (1S,2S,3S,4R)-2-hydroxy-3-iodo-5-azabicyclo[2.2.0]hexane-5-carboxylate CAS Name: (1S,2S,3S,4R)-2-hydroxy-3-iodo-5-azabicyclo[2.2.0]hexane-5-carboxylic acid ethyl ester IUPAC Name: ethyl (1S,2S,3S,4R)-2-hydroxy-3-iodo-5-azabicyclo[2.2.0]hexane-5-carboxylate Traditional Name: (1S,2S,3S,4R)-2-hydroxy-3-iodo-5-azabicyclo[2.2.0]hexane-5-carboxylic acid ethyl ester Formula: C8H12INO3 MolecularWeight: 297.09025

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CC2C1C(C2O)I

Isomeric SMILES

CCOC(=O)N1C[C@H]2[C@@H]1[C@@H]([C@H]2O)I

InChI

InChI=1S/C8H12INO3/c1-2-13-8(12)10-3-4-6(10)5(9)7(4)11/h4-7,11H,2-3H2,1H3/t4-,5-,6+,7-/m0/s1