[(2R,3S,4R)-2-acetamido-1,4-bis(oxidanyl)octadecan-3-yl] ethanoate

Systemtic Name: [(2R,3S,4R)-2-acetamido-1,4-bis(oxidanyl)octadecan-3-yl] ethanoate Openeye Name: [(1S,2R)-1-[(1R)-1-acetamido-2-hydroxy-ethyl]-2-hydroxy-hexadecyl] acetate CAS Name: acetic acid [(2R,3S,4R)-2-acetamido-1,4-dihydroxyoctadecan-3-yl] ester IUPAC Name: [(2R,3S,4R)-2-acetamido-1,4-dihydroxyoctadecan-3-yl] acetate Traditional Name: acetic acid [(1S,2R)-1-[(1R)-1-acetamido-2-hydroxy-ethyl]-2-hydroxy-hexadecyl] ester Formula: C22H43NO5 MolecularWeight: 401.58052

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H43NO5/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-21(27)22(28-19(3)26)20(17-24)23-18(2)25/h20-22,24,27H,4-17H2,1-3H3,(H,23,25)/t20-,21-,22+/m1/s1