[(1S,2R)-2-oxidanyl-6-oxidanylidene-cyclohexyl] 2,2-dimethylpropanoate

Systemtic Name: [(1S,2R)-2-oxidanyl-6-oxidanylidene-cyclohexyl] 2,2-dimethylpropanoate Openeye Name: [(1S,2R)-2-hydroxy-6-oxo-cyclohexyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [(1S,2R)-2-hydroxy-6-oxocyclohexyl] ester IUPAC Name: [(1S,2R)-2-hydroxy-6-oxocyclohexyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [(1S,2R)-2-hydroxy-6-keto-cyclohexyl] ester Formula: C11H18O4 MolecularWeight: 214.25822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OC1C(CCCC1=O)O

Isomeric SMILES

CC(C)(C)C(=O)O[C@H]1[C@@H](CCCC1=O)O

InChI

InChI=1S/C11H18O4/c1-11(2,3)10(14)15-9-7(12)5-4-6-8(9)13/h7,9,12H,4-6H2,1-3H3/t7-,9+/m1/s1