2-ethanoyl-4-methyl-cyclohexane-1,3-dione

Systemtic Name: 2-ethanoyl-4-methyl-cyclohexane-1,3-dione Openeye Name: 2-acetyl-4-methyl-cyclohexane-1,3-dione CAS Name: 2-acetyl-4-methylcyclohexane-1,3-dione IUPAC Name: 2-acetyl-4-methylcyclohexane-1,3-dione Traditional Name: 2-acetyl-4-methyl-cyclohexane-1,3-quinone Formula: C9H12O3 MolecularWeight: 168.18978

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCC(=O)C(C1=O)C(=O)C

Isomeric SMILES

CC1CCC(=O)C(C1=O)C(=O)C

InChI

InChI=1S/C9H12O3/c1-5-3-4-7(11)8(6(2)10)9(5)12/h5,8H,3-4H2,1-2H3