diethyl (1S,6S)-1-methyl-6-oxidanyl-cyclohexa-2,4-diene-1,2-dicarboxylate

Systemtic Name: diethyl (1S,6S)-1-methyl-6-oxidanyl-cyclohexa-2,4-diene-1,2-dicarboxylate Openeye Name: diethyl (1S,6S)-6-hydroxy-1-methyl-cyclohexa-2,4-diene-1,2-dicarboxylate CAS Name: (1S,6S)-6-hydroxy-1-methylcyclohexa-2,4-diene-1,2-dicarboxylic acid diethyl ester IUPAC Name: diethyl (1S,6S)-6-hydroxy-1-methylcyclohexa-2,4-diene-1,2-dicarboxylate Traditional Name: (1S,6S)-6-hydroxy-1-methyl-cyclohexa-2,4-diene-1,2-dicarboxylic acid diethyl ester Formula: C13H18O5 MolecularWeight: 254.27902

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(C1(C)C(=O)OCC)O

Isomeric SMILES

CCOC(=O)C1=CC=C[C@@H]([C@@]1(C)C(=O)OCC)O

InChI

InChI=1S/C13H18O5/c1-4-17-11(15)9-7-6-8-10(14)13(9,3)12(16)18-5-2/h6-8,10,14H,4-5H2,1-3H3/t10-,13-/m0/s1