3-butyl-6-methyl-2-oxidanyl-pyran-4-one

Systemtic Name: 3-butyl-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-butyl-2-hydroxy-6-methyl-pyran-4-one CAS Name: 3-butyl-2-hydroxy-6-methyl-4-pyranone IUPAC Name: 3-butyl-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-butyl-2-hydroxy-6-methyl-pyran-4-one Formula: C10H14O3 MolecularWeight: 182.21636

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=C(OC(=CC1=O)C)O

Isomeric SMILES

CCCCC1=C(OC(=CC1=O)C)O

InChI

InChI=1S/C10H14O3/c1-3-4-5-8-9(11)6-7(2)13-10(8)12/h6,12H,3-5H2,1-2H3