5-methoxy-6,6-dimethyl-2-(2-methylpropanoyl)cyclohex-4-ene-1,3-dione

Systemtic Name: 5-methoxy-6,6-dimethyl-2-(2-methylpropanoyl)cyclohex-4-ene-1,3-dione Openeye Name: 5-methoxy-6,6-dimethyl-2-(2-methylpropanoyl)cyclohex-4-ene-1,3-dione CAS Name: 5-methoxy-6,6-dimethyl-2-(2-methyl-1-oxopropyl)cyclohex-4-ene-1,3-dione IUPAC Name: 5-methoxy-6,6-dimethyl-2-(2-methylpropanoyl)cyclohex-4-ene-1,3-dione Traditional Name: 2-isobutyryl-5-methoxy-6,6-dimethyl-cyclohex-4-ene-1,3-quinone Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1C(=O)C=C(C(C1=O)(C)C)OC

Isomeric SMILES

CC(C)C(=O)C1C(=O)C=C(C(C1=O)(C)C)OC

InChI

InChI=1S/C13H18O4/c1-7(2)11(15)10-8(14)6-9(17-5)13(3,4)12(10)16/h6-7,10H,1-5H3