5-(hydroxymethyl)-2-propanoyl-cyclohexane-1,3-dione

Systemtic Name: 5-(hydroxymethyl)-2-propanoyl-cyclohexane-1,3-dione Openeye Name: 5-(hydroxymethyl)-2-propanoyl-cyclohexane-1,3-dione CAS Name: 5-(hydroxymethyl)-2-(1-oxopropyl)cyclohexane-1,3-dione IUPAC Name: 5-(hydroxymethyl)-2-propanoylcyclohexane-1,3-dione Traditional Name: 5-methylol-2-propionyl-cyclohexane-1,3-quinone Formula: C10H14O4 MolecularWeight: 198.21576

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1C(=O)CC(CC1=O)CO

Isomeric SMILES

CCC(=O)C1C(=O)CC(CC1=O)CO

InChI

InChI=1S/C10H14O4/c1-2-7(12)10-8(13)3-6(5-11)4-9(10)14/h6,10-11H,2-5H2,1H3