N-[2-(hydroxymethyl)-1,3-bis(oxidanyl)-4-oxidanylidene-henicosan-2-yl]octadecanamide

Systemtic Name: N-[2-(hydroxymethyl)-1,3-bis(oxidanyl)-4-oxidanylidene-henicosan-2-yl]octadecanamide Openeye Name: N-[2-hydroxy-1,1-bis(hydroxymethyl)-3-oxo-icosyl]octadecanamide CAS Name: N-[1,3-dihydroxy-2-(hydroxymethyl)-4-oxoheneicosan-2-yl]octadecanamide IUPAC Name: N-[1,3-dihydroxy-2-(hydroxymethyl)-4-oxohenicosan-2-yl]octadecanamide Traditional Name: N-(2-hydroxy-3-keto-1,1-dimethylol-eicosyl)stearamide Formula: C40H79NO5 MolecularWeight: 654.05896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C40H79NO5/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-37(44)39(46)40(35-42,36-43)41-38(45)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h39,42-43,46H,3-36H2,1-2H3,(H,41,45)