[(1R,2S,3R)-2-iodanyl-3-oxidanyl-cyclohexyl] 2,2-dimethylpropanoate

Systemtic Name: [(1R,2S,3R)-2-iodanyl-3-oxidanyl-cyclohexyl] 2,2-dimethylpropanoate Openeye Name: [(1R,2S,3R)-3-hydroxy-2-iodo-cyclohexyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(1R,2S,3R)-3-hydroxy-2-iodocyclohexyl] ester IUPAC Name: [(1R,2S,3R)-3-hydroxy-2-iodocyclohexyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(1R,2S,3R)-3-hydroxy-2-iodo-cyclohexyl] ester Formula: C11H19IO3 MolecularWeight: 326.17123

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1CCCC(C1I)O

Isomeric SMILES

CC(C)(C)C(=O)O[C@@H]1CCC[C@H]([C@@H]1I)O

InChI

InChI=1S/C11H19IO3/c1-11(2,3)10(14)15-8-6-4-5-7(13)9(8)12/h7-9,13H,4-6H2,1-3H3/t7-,8-,9+/m1/s1