3-hexanoyl-2-oxidanyl-6-pentyl-pyran-4-one

Systemtic Name: 3-hexanoyl-2-oxidanyl-6-pentyl-pyran-4-one Openeye Name: 3-hexanoyl-2-hydroxy-6-pentyl-pyran-4-one CAS Name: 2-hydroxy-3-(1-oxohexyl)-6-pentyl-4-pyranone IUPAC Name: 3-hexanoyl-2-hydroxy-6-pentylpyran-4-one Traditional Name: 6-amyl-3-caproyl-2-hydroxy-pyran-4-one Formula: C16H24O4 MolecularWeight: 280.35936

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC(=O)C(=C(O1)O)C(=O)CCCCC

Isomeric SMILES

CCCCCC1=CC(=O)C(=C(O1)O)C(=O)CCCCC

InChI

InChI=1S/C16H24O4/c1-3-5-7-9-12-11-14(18)15(16(19)20-12)13(17)10-8-6-4-2/h11,19H,3-10H2,1-2H3