3-hexanoyl-6-methyl-2-oxidanyl-1H-pyridin-4-one

Systemtic Name: 3-hexanoyl-6-methyl-2-oxidanyl-1H-pyridin-4-one Openeye Name: 3-hexanoyl-2-hydroxy-6-methyl-1H-pyridin-4-one CAS Name: 2-hydroxy-6-methyl-3-(1-oxohexyl)-1H-pyridin-4-one IUPAC Name: 3-hexanoyl-2-hydroxy-6-methyl-1H-pyridin-4-one Traditional Name: 3-caproyl-2-hydroxy-6-methyl-4-pyridone Formula: C12H17NO3 MolecularWeight: 223.26828

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1=C(NC(=CC1=O)C)O

Isomeric SMILES

CCCCCC(=O)C1=C(NC(=CC1=O)C)O

InChI

InChI=1S/C12H17NO3/c1-3-4-5-6-9(14)11-10(15)7-8(2)13-12(11)16/h7H,3-6H2,1-2H3,(H2,13,15,16)