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

Systemtic Name: 3-butanoyl-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-butanoyl-2-hydroxy-6-methyl-pyran-4-one CAS Name: 2-hydroxy-6-methyl-3-(1-oxobutyl)-4-pyranone IUPAC Name: 3-butanoyl-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-butyryl-2-hydroxy-6-methyl-pyran-4-one Formula: C10H12O4 MolecularWeight: 196.19988

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C1=C(OC(=CC1=O)C)O

Isomeric SMILES

CCCC(=O)C1=C(OC(=CC1=O)C)O

InChI

InChI=1S/C10H12O4/c1-3-4-7(11)9-8(12)5-6(2)14-10(9)13/h5,13H,3-4H2,1-2H3