methyl (4S,5R)-4,5-bis(oxidanyl)-3-oxidanylidene-cyclohexene-1-carboxylate

Systemtic Name: methyl (4S,5R)-4,5-bis(oxidanyl)-3-oxidanylidene-cyclohexene-1-carboxylate Openeye Name: methyl (4S,5R)-4,5-dihydroxy-3-oxo-cyclohexene-1-carboxylate CAS Name: (4S,5R)-4,5-dihydroxy-3-oxo-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl (4S,5R)-4,5-dihydroxy-3-oxocyclohexene-1-carboxylate Traditional Name: (4S,5R)-4,5-dihydroxy-3-keto-cyclohexene-1-carboxylic acid methyl ester Formula: C8H10O5 MolecularWeight: 186.162

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=O)C(C(C1)O)O

Isomeric SMILES

COC(=O)C1=CC(=O)[C@H]([C@@H](C1)O)O

InChI

InChI=1S/C8H10O5/c1-13-8(12)4-2-5(9)7(11)6(10)3-4/h2,6-7,10-11H,3H2,1H3/t6-,7-/m1/s1