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

Systemtic Name: N-[2-methyl-1,3-bis(oxidanyl)-4-oxidanylidene-henicosan-2-yl]octadecanamide Openeye Name: N-[2-hydroxy-1-(hydroxymethyl)-1-methyl-3-oxo-icosyl]octadecanamide CAS Name: N-(1,3-dihydroxy-2-methyl-4-oxoheneicosan-2-yl)octadecanamide IUPAC Name: N-(1,3-dihydroxy-2-methyl-4-oxohenicosan-2-yl)octadecanamide Traditional Name: N-(2-hydroxy-3-keto-1-methyl-1-methylol-eicosyl)stearamide Formula: C40H79NO4 MolecularWeight: 638.05956

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C40H79NO4/c1-4-6-8-10-12-14-16-18-20-22-24-26-28-30-32-34-37(43)39(45)40(3,36-42)41-38(44)35-33-31-29-27-25-23-21-19-17-15-13-11-9-7-5-2/h39,42,45H,4-36H2,1-3H3,(H,41,44)