(4-hexadecanoyl-5-oxidanyl-3-oxidanylidene-furan-2-yl)methyl methanesulfonate

Systemtic Name: (4-hexadecanoyl-5-oxidanyl-3-oxidanylidene-furan-2-yl)methyl methanesulfonate Openeye Name: (4-hexadecanoyl-5-hydroxy-3-oxo-2-furyl)methyl methanesulfonate CAS Name: methanesulfonic acid [5-hydroxy-3-oxo-4-(1-oxohexadecyl)-2-furanyl]methyl ester IUPAC Name: (4-hexadecanoyl-5-hydroxy-3-oxofuran-2-yl)methyl methanesulfonate Traditional Name: methanesulfonic acid (4-hexadecanoyl-5-hydroxy-3-keto-2-furyl)methyl ester Formula: C22H38O7S MolecularWeight: 446.59792

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H38O7S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18(23)20-21(24)19(29-22(20)25)17-28-30(2,26)27/h19,25H,3-17H2,1-2H3