copper; 2-ethanoyl-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one

Systemtic Name: copper; 2-ethanoyl-5,5-dimethyl-3-oxidanyl-cyclohex-2-en-1-one Openeye Name: 2-acetyl-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one; copper CAS Name: 2-acetyl-3-hydroxy-5,5-dimethyl-1-cyclohex-2-enone; copper IUPAC Name: 2-acetyl-3-hydroxy-5,5-dimethylcyclohex-2-en-1-one; copper Traditional Name: 2-acetyl-3-hydroxy-5,5-dimethyl-cyclohex-2-en-1-one; copper Formula: C20H28CuO6 MolecularWeight: 427.97872

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(CC(CC1=O)(C)C)O.CC(=O)C1=C(CC(CC1=O)(C)C)O.[Cu]

Isomeric SMILES

CC(=O)C1=C(CC(CC1=O)(C)C)O.CC(=O)C1=C(CC(CC1=O)(C)C)O.[Cu]

InChI

InChI=1S/2C10H14O3.Cu/c2*1-6(11)9-7(12)4-10(2,3)5-8(9)13;/h2*12H,4-5H2,1-3H3;