N-[(2S,3S,4R)-1,3,4-tris(oxidanyl)henicosan-2-yl]docosanamide

Systemtic Name: N-[(2S,3S,4R)-1,3,4-tris(oxidanyl)henicosan-2-yl]docosanamide Openeye Name: N-[(1S,2S,3R)-2,3-dihydroxy-1-(hydroxymethyl)icosyl]docosanamide CAS Name: N-[(2S,3S,4R)-1,3,4-trihydroxyheneicosan-2-yl]docosanamide IUPAC Name: N-[(2S,3S,4R)-1,3,4-trihydroxyhenicosan-2-yl]docosanamide Traditional Name: N-[(1S,2S,3R)-2,3-dihydroxy-1-methylol-eicosyl]behenamide Formula: C43H87NO4 MolecularWeight: 682.15518

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCCCCC(=O)NC(CO)C(C(CCCCCCCCCCCCCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO)[C@@H]([C@@H](CCCCCCCCCCCCCCCCC)O)O

InChI

InChI=1S/C43H87NO4/c1-3-5-7-9-11-13-15-17-19-20-21-22-24-26-28-30-32-34-36-38-42(47)44-40(39-45)43(48)41(46)37-35-33-31-29-27-25-23-18-16-14-12-10-8-6-4-2/h40-41,43,45-46,48H,3-39H2,1-2H3,(H,44,47)/t40-,41+,43-/m0/s1