tert-butyl N-[(2S,3R)-1,3-bis(oxidanyl)heptadecan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3R)-1,3-bis(oxidanyl)heptadecan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2R)-2-hydroxy-1-(hydroxymethyl)hexadecyl]carbamate CAS Name: N-[(2S,3R)-1,3-dihydroxyheptadecan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3R)-1,3-dihydroxyheptadecan-2-yl]carbamate Traditional Name: N-[(1S,2R)-2-hydroxy-1-methylol-hexadecyl]carbamic acid tert-butyl ester Formula: C22H45NO4 MolecularWeight: 387.597

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H45NO4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20(25)19(18-24)23-21(26)27-22(2,3)4/h19-20,24-25H,5-18H2,1-4H3,(H,23,26)/t19-,20+/m0/s1