diethyl (1S,3R,4S)-4-methyl-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate

Systemtic Name: diethyl (1S,3R,4S)-4-methyl-4-oxidanyl-6-oxidanylidene-cyclohexane-1,3-dicarboxylate Openeye Name: diethyl (1S,3R,4S)-4-hydroxy-4-methyl-6-oxo-cyclohexane-1,3-dicarboxylate CAS Name: (1S,3R,4S)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl (1S,3R,4S)-4-hydroxy-4-methyl-6-oxocyclohexane-1,3-dicarboxylate Traditional Name: (1S,3R,4S)-4-hydroxy-6-keto-4-methyl-cyclohexane-1,3-dicarboxylic acid diethyl ester Formula: C13H20O6 MolecularWeight: 272.2943

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CC(C(CC1=O)(C)O)C(=O)OCC

Isomeric SMILES

CCOC(=O)[C@H]1C[C@H]([C@@](CC1=O)(C)O)C(=O)OCC

InChI

InChI=1S/C13H20O6/c1-4-18-11(15)8-6-9(12(16)19-5-2)13(3,17)7-10(8)14/h8-9,17H,4-7H2,1-3H3/t8-,9-,13-/m0/s1