N-[1,3-bis(oxidanyl)-4-oxidanylidene-heptadecan-2-yl]docosanamide

Systemtic Name: N-[1,3-bis(oxidanyl)-4-oxidanylidene-heptadecan-2-yl]docosanamide Openeye Name: N-[2-hydroxy-1-(hydroxymethyl)-3-oxo-hexadecyl]docosanamide CAS Name: N-(1,3-dihydroxy-4-oxoheptadecan-2-yl)docosanamide IUPAC Name: N-(1,3-dihydroxy-4-oxoheptadecan-2-yl)docosanamide Traditional Name: N-(2-hydroxy-3-keto-1-methylol-hexadecyl)behenamide Formula: C39H77NO4 MolecularWeight: 624.03298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C39H77NO4/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-24-26-28-30-32-34-38(43)40-36(35-41)39(44)37(42)33-31-29-27-25-23-14-12-10-8-6-4-2/h36,39,41,44H,3-35H2,1-2H3,(H,40,43)