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

Systemtic Name: 3-methyl-N-[(2S,3S,4R)-1,3,4-tris(oxidanyl)octadecan-2-yl]butanamide Openeye Name: N-[(1S,2S,3R)-2,3-dihydroxy-1-(hydroxymethyl)heptadecyl]-3-methyl-butanamide CAS Name: 3-methyl-N-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]butanamide IUPAC Name: 3-methyl-N-[(2S,3S,4R)-1,3,4-trihydroxyoctadecan-2-yl]butanamide Traditional Name: N-[(1S,2S,3R)-2,3-dihydroxy-1-methylol-heptadecyl]-3-methyl-butyramide Formula: C23H47NO4 MolecularWeight: 401.62358

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H47NO4/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-21(26)23(28)20(18-25)24-22(27)17-19(2)3/h19-21,23,25-26,28H,4-18H2,1-3H3,(H,24,27)/t20-,21+,23-/m0/s1