dimethyl (1S,6S)-1,3-dimethyl-6-oxidanyl-cyclohexa-2,4-diene-1,2-dicarboxylate

Systemtic Name: dimethyl (1S,6S)-1,3-dimethyl-6-oxidanyl-cyclohexa-2,4-diene-1,2-dicarboxylate Openeye Name: dimethyl (1S,6S)-6-hydroxy-1,3-dimethyl-cyclohexa-2,4-diene-1,2-dicarboxylate CAS Name: (1S,6S)-6-hydroxy-1,3-dimethylcyclohexa-2,4-diene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (1S,6S)-6-hydroxy-1,3-dimethylcyclohexa-2,4-diene-1,2-dicarboxylate Traditional Name: (1S,6S)-6-hydroxy-1,3-dimethyl-cyclohexa-2,4-diene-1,2-dicarboxylic acid dimethyl ester Formula: C12H16O5 MolecularWeight: 240.25244

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(C=C1)O)(C)C(=O)OC)C(=O)OC

Isomeric SMILES

CC1=C([C@]([C@H](C=C1)O)(C)C(=O)OC)C(=O)OC

InChI

InChI=1S/C12H16O5/c1-7-5-6-8(13)12(2,11(15)17-4)9(7)10(14)16-3/h5-6,8,13H,1-4H3/t8-,12+/m0/s1