2-oxidanylidene-N-[(2S,3S,4R)-1,3,4-tris(oxidanyl)octadecan-2-yl]octanamide

Systemtic Name: 2-oxidanylidene-N-[(2S,3S,4R)-1,3,4-tris(oxidanyl)octadecan-2-yl]octanamide Openeye Name: N-[(1S,2S,3R)-2,3-dihydroxy-1-(hydroxymethyl)heptadecyl]-2-oxo-octanamide CAS Name: 2-oxo-N-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]octanamide IUPAC Name: 2-oxo-N-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]octanamide Traditional Name: N-[(1S,2S,3R)-2,3-dihydroxy-1-methylol-heptadecyl]-2-keto-caprylamide Formula: C26H51NO5 MolecularWeight: 457.68684

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCC(C(C(CO)NC(=O)C(=O)CCCCCC)O)O

Isomeric SMILES

CCCCCCCCCCCCCC[C@H]([C@H]([C@H](CO)NC(=O)C(=O)CCCCCC)O)O

InChI

InChI=1S/C26H51NO5/c1-3-5-7-9-10-11-12-13-14-15-16-18-19-23(29)25(31)22(21-28)27-26(32)24(30)20-17-8-6-4-2/h22-23,25,28-29,31H,3-21H2,1-2H3,(H,27,32)/t22-,23+,25-/m0/s1