sodium 2-(hydroxymethyl)-4-(14-methylhexadecanoyl)-5-oxidanylidene-2H-furan-3-olate

Systemtic Name: sodium 2-(hydroxymethyl)-4-(14-methylhexadecanoyl)-5-oxidanylidene-2H-furan-3-olate Openeye Name: sodium 2-(hydroxymethyl)-4-(14-methylhexadecanoyl)-5-oxo-2H-furan-3-olate CAS Name: sodium 2-(hydroxymethyl)-4-(14-methyl-1-oxohexadecyl)-5-oxo-2H-furan-3-olate IUPAC Name: sodium 2-(hydroxymethyl)-4-(14-methylhexadecanoyl)-5-oxo-2H-furan-3-olate Traditional Name: sodium 5-keto-4-(14-methylhexadecanoyl)-2-methylol-2H-furan-3-olate Formula: C22H37NaO5 MolecularWeight: 404.51595

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)CCCCCCCCCCCCC(=O)C1=C(C(OC1=O)CO)[O-].[Na+]

Isomeric SMILES

CCC(C)CCCCCCCCCCCCC(=O)C1=C(C(OC1=O)CO)[O-].[Na+]

InChI

InChI=1S/C22H38O5.Na/c1-3-17(2)14-12-10-8-6-4-5-7-9-11-13-15-18(24)20-21(25)19(16-23)27-22(20)26;/h17,19,23,25H,3-16H2,1-2H3;/q;+1/p-1