2-ethanoyl-4,5,5-trimethyl-cyclohexane-1,3-dione

Systemtic Name: 2-ethanoyl-4,5,5-trimethyl-cyclohexane-1,3-dione Openeye Name: 2-acetyl-4,5,5-trimethyl-cyclohexane-1,3-dione CAS Name: 2-acetyl-4,5,5-trimethylcyclohexane-1,3-dione IUPAC Name: 2-acetyl-4,5,5-trimethylcyclohexane-1,3-dione Traditional Name: 2-acetyl-4,5,5-trimethyl-cyclohexane-1,3-quinone Formula: C11H16O3 MolecularWeight: 196.24294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)C(C(=O)CC1(C)C)C(=O)C

Isomeric SMILES

CC1C(=O)C(C(=O)CC1(C)C)C(=O)C

InChI

InChI=1S/C11H16O3/c1-6-10(14)9(7(2)12)8(13)5-11(6,3)4/h6,9H,5H2,1-4H3