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

Systemtic Name: methyl (3R,4R,5S)-5-acetyloxy-5-deuterio-3,4-bis(oxidanyl)cyclohexene-1-carboxylate Openeye Name: methyl (3R,4R,5S)-5-acetoxy-5-deuterio-3,4-dihydroxy-cyclohexene-1-carboxylate CAS Name: (3R,4R,5S)-5-acetyloxy-5-deuterio-3,4-dihydroxy-1-cyclohexenecarboxylic acid methyl ester IUPAC Name: methyl (3R,4R,5S)-5-acetyloxy-5-deuterio-3,4-dihydroxycyclohexene-1-carboxylate Traditional Name: (3R,4R,5S)-5-acetoxy-5-deuterio-3,4-dihydroxy-cyclohexene-1-carboxylic acid methyl ester Formula: C10H14O6 MolecularWeight: 231.220722

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OC1CC(=CC(C1O)O)C(=O)OC

Isomeric SMILES

[2H][C@@]1(CC(=C[C@H]([C@H]1O)O)C(=O)OC)OC(=O)C

InChI

InChI=1S/C10H14O6/c1-5(11)16-8-4-6(10(14)15-2)3-7(12)9(8)13/h3,7-9,12-13H,4H2,1-2H3/t7-,8+,9-/m1/s1/i8D