3-hexanoyl-2-methyl-6-oxidanyl-2,3-dihydropyran-4-one

Systemtic Name: 3-hexanoyl-2-methyl-6-oxidanyl-2,3-dihydropyran-4-one Openeye Name: 3-hexanoyl-6-hydroxy-2-methyl-2,3-dihydropyran-4-one CAS Name: 6-hydroxy-2-methyl-3-(1-oxohexyl)-2,3-dihydropyran-4-one IUPAC Name: 3-hexanoyl-6-hydroxy-2-methyl-2,3-dihydropyran-4-one Traditional Name: 3-caproyl-6-hydroxy-2-methyl-2,3-dihydropyran-4-one Formula: C12H18O4 MolecularWeight: 226.26892

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(=O)C1C(OC(=CC1=O)O)C

Isomeric SMILES

CCCCCC(=O)C1C(OC(=CC1=O)O)C

InChI

InChI=1S/C12H18O4/c1-3-4-5-6-9(13)12-8(2)16-11(15)7-10(12)14/h7-8,12,15H,3-6H2,1-2H3