methyl 3-methyl-4-(2-methylpropoxy)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate

Systemtic Name: methyl 3-methyl-4-(2-methylpropoxy)-2-oxidanylidene-cyclohex-3-ene-1-carboxylate Openeye Name: methyl 4-isobutoxy-3-methyl-2-oxo-cyclohex-3-ene-1-carboxylate CAS Name: 3-methyl-4-(2-methylpropoxy)-2-oxo-1-cyclohex-3-enecarboxylic acid methyl ester IUPAC Name: methyl 3-methyl-4-(2-methylpropoxy)-2-oxocyclohex-3-ene-1-carboxylate Traditional Name: 4-isobutoxy-2-keto-3-methyl-cyclohex-3-ene-1-carboxylic acid methyl ester Formula: C13H20O4 MolecularWeight: 240.2955

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H20O4/c1-8(2)7-17-11-6-5-10(13(15)16-4)12(14)9(11)3/h8,10H,5-7H2,1-4H3