sodium 3-hexadecanoyl-5-(hydroxymethyl)-4-oxidanylidene-furan-2-olate

Systemtic Name: sodium 3-hexadecanoyl-5-(hydroxymethyl)-4-oxidanylidene-furan-2-olate Openeye Name: sodium 3-hexadecanoyl-5-(hydroxymethyl)-4-oxo-furan-2-olate CAS Name: sodium 5-(hydroxymethyl)-4-oxo-3-(1-oxohexadecyl)-2-furanolate IUPAC Name: sodium 3-hexadecanoyl-5-(hydroxymethyl)-4-oxofuran-2-olate Traditional Name: sodium 3-hexadecanoyl-4-keto-5-methylol-furan-2-olate Formula: C21H35NaO5 MolecularWeight: 390.48937

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCC(=O)C1=C(OC(C1=O)CO)[O-].[Na+]

Isomeric SMILES

CCCCCCCCCCCCCCCC(=O)C1=C(OC(C1=O)CO)[O-].[Na+]

InChI

InChI=1S/C21H36O5.Na/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-17(23)19-20(24)18(16-22)26-21(19)25;/h18,22,25H,2-16H2,1H3;/q;+1/p-1