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

Systemtic Name: methyl (1S,6R)-2-methyl-6-(2-methylpropyl)-4-oxidanylidene-cyclohex-2-ene-1-carboxylate Openeye Name: methyl (1S,6R)-6-isobutyl-2-methyl-4-oxo-cyclohex-2-ene-1-carboxylate CAS Name: (1S,6R)-2-methyl-6-(2-methylpropyl)-4-oxo-1-cyclohex-2-enecarboxylic acid methyl ester IUPAC Name: methyl (1S,6R)-2-methyl-6-(2-methylpropyl)-4-oxocyclohex-2-ene-1-carboxylate Traditional Name: (1S,6R)-6-isobutyl-4-keto-2-methyl-cyclohex-2-ene-1-carboxylic acid methyl ester Formula: C13H20O3 MolecularWeight: 224.2961

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)CC(C1C(=O)OC)CC(C)C

Isomeric SMILES

CC1=CC(=O)C[C@H]([C@@H]1C(=O)OC)CC(C)C

InChI

InChI=1S/C13H20O3/c1-8(2)5-10-7-11(14)6-9(3)12(10)13(15)16-4/h6,8,10,12H,5,7H2,1-4H3/t10-,12-/m1/s1