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

Systemtic Name: 5-(hydroxymethyl)-2-(1-oxidanylbutylidene)cyclohexane-1,3-dione Openeye Name: 2-(1-hydroxybutylidene)-5-(hydroxymethyl)cyclohexane-1,3-dione CAS Name: 2-(1-hydroxybutylidene)-5-(hydroxymethyl)cyclohexane-1,3-dione IUPAC Name: 2-(1-hydroxybutylidene)-5-(hydroxymethyl)cyclohexane-1,3-dione Traditional Name: 2-(1-hydroxybutylidene)-5-methylol-cyclohexane-1,3-quinone Formula: C11H16O4 MolecularWeight: 212.24234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H16O4/c1-2-3-8(13)11-9(14)4-7(6-12)5-10(11)15/h7,12-13H,2-6H2,1H3