2-butanoyl-4,6,6-trimethyl-5-oxidanyl-cyclohex-4-ene-1,3-dione

Systemtic Name: 2-butanoyl-4,6,6-trimethyl-5-oxidanyl-cyclohex-4-ene-1,3-dione Openeye Name: 2-butanoyl-5-hydroxy-4,6,6-trimethyl-cyclohex-4-ene-1,3-dione CAS Name: 5-hydroxy-4,6,6-trimethyl-2-(1-oxobutyl)cyclohex-4-ene-1,3-dione IUPAC Name: 2-butanoyl-5-hydroxy-4,6,6-trimethylcyclohex-4-ene-1,3-dione Traditional Name: 2-butyryl-5-hydroxy-4,6,6-trimethyl-cyclohex-4-ene-1,3-quinone Formula: C13H18O4 MolecularWeight: 238.27962

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1C(=O)C(=C(C(C1=O)(C)C)O)C

Isomeric SMILES

CCCC(=O)C1C(=O)C(=C(C(C1=O)(C)C)O)C

InChI

InChI=1S/C13H18O4/c1-5-6-8(14)9-10(15)7(2)11(16)13(3,4)12(9)17/h9,16H,5-6H2,1-4H3