7-methyl-5-(2-methylpropanoyl)octane-2,6-dione

Systemtic Name: 7-methyl-5-(2-methylpropanoyl)octane-2,6-dione Openeye Name: 7-methyl-5-(2-methylpropanoyl)octane-2,6-dione CAS Name: 7-methyl-5-(2-methyl-1-oxopropyl)octane-2,6-dione IUPAC Name: 7-methyl-5-(2-methylpropanoyl)octane-2,6-dione Traditional Name: 5-isobutyryl-7-methyl-octane-2,6-dione Formula: C13H22O3 MolecularWeight: 226.31198

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C(CCC(=O)C)C(=O)C(C)C

Isomeric SMILES

CC(C)C(=O)C(CCC(=O)C)C(=O)C(C)C

InChI

InChI=1S/C13H22O3/c1-8(2)12(15)11(7-6-10(5)14)13(16)9(3)4/h8-9,11H,6-7H2,1-5H3