[(1S,2R)-2-oxidanyl-3-oxidanylidene-cyclohexyl] ethanoate

Systemtic Name: [(1S,2R)-2-oxidanyl-3-oxidanylidene-cyclohexyl] ethanoate Openeye Name: [(1S,2R)-2-hydroxy-3-oxo-cyclohexyl] acetate CAS Name: acetic acid [(1S,2R)-2-hydroxy-3-oxocyclohexyl] ester IUPAC Name: [(1S,2R)-2-hydroxy-3-oxocyclohexyl] acetate Traditional Name: acetic acid [(1S,2R)-2-hydroxy-3-keto-cyclohexyl] ester Formula: C8H12O4 MolecularWeight: 172.17848

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CCCC(=O)C1O

Isomeric SMILES

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

InChI

InChI=1S/C8H12O4/c1-5(9)12-7-4-2-3-6(10)8(7)11/h7-8,11H,2-4H2,1H3/t7-,8-/m0/s1