tert-butyl N-[(2S,3S,4R)-1-azanyl-3,4-bis(oxidanyl)octadecan-2-yl]carbamate

Systemtic Name: tert-butyl N-[(2S,3S,4R)-1-azanyl-3,4-bis(oxidanyl)octadecan-2-yl]carbamate Openeye Name: tert-butyl N-[(1S,2S,3R)-1-(aminomethyl)-2,3-dihydroxy-heptadecyl]carbamate CAS Name: N-[(2S,3S,4R)-1-amino-3,4-dihydroxyoctadecan-2-yl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[(2S,3S,4R)-1-amino-3,4-dihydroxyoctadecan-2-yl]carbamate Traditional Name: N-[(1S,2S,3R)-1-(aminomethyl)-2,3-dihydroxy-heptadecyl]carbamic acid tert-butyl ester Formula: C23H48N2O4 MolecularWeight: 416.63822

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H48N2O4/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20(26)21(27)19(18-24)25-22(28)29-23(2,3)4/h19-21,26-27H,5-18,24H2,1-4H3,(H,25,28)/t19-,20+,21-/m0/s1