3-ethoxy-2-methyl-5-oxidanyl-6-pentyl-pyran-4-one

Systemtic Name: 3-ethoxy-2-methyl-5-oxidanyl-6-pentyl-pyran-4-one Openeye Name: 3-ethoxy-5-hydroxy-2-methyl-6-pentyl-pyran-4-one CAS Name: 3-ethoxy-5-hydroxy-2-methyl-6-pentyl-4-pyranone IUPAC Name: 3-ethoxy-5-hydroxy-2-methyl-6-pentylpyran-4-one Traditional Name: 2-amyl-5-ethoxy-3-hydroxy-6-methyl-pyran-4-one Formula: C13H20O4 MolecularWeight: 240.2955

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C(=O)C(=C(O1)C)OCC)O

Isomeric SMILES

CCCCCC1=C(C(=O)C(=C(O1)C)OCC)O

InChI

InChI=1S/C13H20O4/c1-4-6-7-8-10-11(14)12(15)13(16-5-2)9(3)17-10/h14H,4-8H2,1-3H3