2-ethanoyl-5-methyl-6-oxidanyl-cyclohex-4-ene-1,3-dione

Systemtic Name: 2-ethanoyl-5-methyl-6-oxidanyl-cyclohex-4-ene-1,3-dione Openeye Name: 2-acetyl-6-hydroxy-5-methyl-cyclohex-4-ene-1,3-dione CAS Name: 2-acetyl-6-hydroxy-5-methylcyclohex-4-ene-1,3-dione IUPAC Name: 2-acetyl-6-hydroxy-5-methylcyclohex-4-ene-1,3-dione Traditional Name: 2-acetyl-6-hydroxy-5-methyl-cyclohex-4-ene-1,3-quinone Formula: C9H10O4 MolecularWeight: 182.1733

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)C(C(=O)C1O)C(=O)C

Isomeric SMILES

CC1=CC(=O)C(C(=O)C1O)C(=O)C

InChI

InChI=1S/C9H10O4/c1-4-3-6(11)7(5(2)10)9(13)8(4)12/h3,7-8,12H,1-2H3