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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CCC(C)CCCCCCCCCCCCC(=O)C1=C(OC(C1=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;/h17,19,23,26H,3-16H2,1-2H3;/q;+1/p-1