5-ethanoyl-2,2-dimethyl-6-oxidanyl-3H-pyran-4-one

Systemtic Name: 5-ethanoyl-2,2-dimethyl-6-oxidanyl-3H-pyran-4-one Openeye Name: 5-acetyl-6-hydroxy-2,2-dimethyl-3H-pyran-4-one CAS Name: 5-acetyl-6-hydroxy-2,2-dimethyl-3H-pyran-4-one IUPAC Name: 5-acetyl-6-hydroxy-2,2-dimethyl-3H-pyran-4-one Traditional Name: 5-acetyl-6-hydroxy-2,2-dimethyl-3H-pyran-4-one Formula: C9H12O4 MolecularWeight: 184.18918

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(OC(CC1=O)(C)C)O

Isomeric SMILES

CC(=O)C1=C(OC(CC1=O)(C)C)O

InChI

InChI=1S/C9H12O4/c1-5(10)7-6(11)4-9(2,3)13-8(7)12/h12H,4H2,1-3H3