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

Systemtic Name: 3-hexadecanoyl-6-methyl-2-oxidanyl-pyran-4-one Openeye Name: 3-hexadecanoyl-2-hydroxy-6-methyl-pyran-4-one CAS Name: 2-hydroxy-6-methyl-3-(1-oxohexadecyl)-4-pyranone IUPAC Name: 3-hexadecanoyl-2-hydroxy-6-methylpyran-4-one Traditional Name: 3-hexadecanoyl-2-hydroxy-6-methyl-pyran-4-one Formula: C22H36O4 MolecularWeight: 364.51884

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H36O4/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19(23)21-20(24)17-18(2)26-22(21)25/h17,25H,3-16H2,1-2H3