N-[1,3-bis(oxidanyl)propan-2-yl]-2-hexadecyl-3-oxidanylidene-icosanamide

Systemtic Name: N-[1,3-bis(oxidanyl)propan-2-yl]-2-hexadecyl-3-oxidanylidene-icosanamide Openeye Name: 2-hexadecyl-N-[2-hydroxy-1-(hydroxymethyl)ethyl]-3-oxo-icosanamide CAS Name: N-(1,3-dihydroxypropan-2-yl)-2-hexadecyl-3-oxoeicosanamide IUPAC Name: N-(1,3-dihydroxypropan-2-yl)-2-hexadecyl-3-oxoicosanamide Traditional Name: 2-cetyl-N-(2-hydroxy-1-methylol-ethyl)-3-keto-arachidamide Formula: C39H77NO4 MolecularWeight: 624.03298

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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