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

Systemtic Name: 5,5-dimethyl-2-(1-oxidanylbutylidene)cyclohexane-1,3-dione Openeye Name: 2-(1-hydroxybutylidene)-5,5-dimethyl-cyclohexane-1,3-dione CAS Name: 2-(1-hydroxybutylidene)-5,5-dimethylcyclohexane-1,3-dione IUPAC Name: 2-(1-hydroxybutylidene)-5,5-dimethylcyclohexane-1,3-dione Traditional Name: 2-(1-hydroxybutylidene)-5,5-dimethyl-cyclohexane-1,3-quinone Formula: C12H18O3 MolecularWeight: 210.26952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18O3/c1-4-5-8(13)11-9(14)6-12(2,3)7-10(11)15/h13H,4-7H2,1-3H3