3-ethanoyl-6,6-dimethyl-oxane-2,4-dione

Systemtic Name: 3-ethanoyl-6,6-dimethyl-oxane-2,4-dione Openeye Name: 3-acetyl-6,6-dimethyl-tetrahydropyran-2,4-dione CAS Name: 3-acetyl-6,6-dimethyloxane-2,4-dione IUPAC Name: 3-acetyl-6,6-dimethyloxane-2,4-dione Traditional Name: 3-acetyl-6,6-dimethyl-tetrahydropyran-2,4-quinone Formula: C9H12O4 MolecularWeight: 184.18918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1C(=O)CC(OC1=O)(C)C

Isomeric SMILES

CC(=O)C1C(=O)CC(OC1=O)(C)C

InChI

InChI=1S/C9H12O4/c1-5(10)7-6(11)4-9(2,3)13-8(7)12/h7H,4H2,1-3H3