5,5-dimethyl-2-(2-methylpropanoyl)cyclohexane-1,3-dione

Systemtic Name: 5,5-dimethyl-2-(2-methylpropanoyl)cyclohexane-1,3-dione Openeye Name: 5,5-dimethyl-2-(2-methylpropanoyl)cyclohexane-1,3-dione CAS Name: 5,5-dimethyl-2-(2-methyl-1-oxopropyl)cyclohexane-1,3-dione IUPAC Name: 5,5-dimethyl-2-(2-methylpropanoyl)cyclohexane-1,3-dione Traditional Name: 2-isobutyryl-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C12H18O3 MolecularWeight: 210.26952

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18O3/c1-7(2)11(15)10-8(13)5-12(3,4)6-9(10)14/h7,10H,5-6H2,1-4H3