methyl (1R,6S)-6-methyl-2-oxidanyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate

Systemtic Name: methyl (1R,6S)-6-methyl-2-oxidanyl-4-oxidanylidene-cyclohex-2-ene-1-carboxylate Openeye Name: methyl (1R,6S)-2-hydroxy-6-methyl-4-oxo-cyclohex-2-ene-1-carboxylate CAS Name: (1R,6S)-2-hydroxy-6-methyl-4-oxo-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl (1R,6S)-2-hydroxy-6-methyl-4-oxocyclohex-2-ene-1-carboxylate Traditional Name: (1R,6S)-2-hydroxy-4-keto-6-methyl-cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C9H12O4 MolecularWeight: 184.18918

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C=C(C1C(=O)OC)O

Isomeric SMILES

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

InChI

InChI=1S/C9H12O4/c1-5-3-6(10)4-7(11)8(5)9(12)13-2/h4-5,8,11H,3H2,1-2H3/t5-,8+/m0/s1