2-hexadecyl-5-(hydroxymethyl)pyran-4-one

Systemtic Name: 2-hexadecyl-5-(hydroxymethyl)pyran-4-one Openeye Name: 2-hexadecyl-5-(hydroxymethyl)pyran-4-one CAS Name: 2-hexadecyl-5-(hydroxymethyl)-4-pyranone IUPAC Name: 2-hexadecyl-5-(hydroxymethyl)pyran-4-one Traditional Name: 2-cetyl-5-methylol-pyran-4-one Formula: C22H38O3 MolecularWeight: 350.53532

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC1=CC(=O)C(=CO1)CO

Isomeric SMILES

CCCCCCCCCCCCCCCCC1=CC(=O)C(=CO1)CO

InChI

InChI=1S/C22H38O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-17-22(24)20(18-23)19-25-21/h17,19,23H,2-16,18H2,1H3