N-[(2S,3S,4R)-1-azanyl-3,4-bis(oxidanyl)octadecan-2-yl]-2,2-dimethyl-propanamide

Systemtic Name: N-[(2S,3S,4R)-1-azanyl-3,4-bis(oxidanyl)octadecan-2-yl]-2,2-dimethyl-propanamide Openeye Name: N-[(1S,2S,3R)-1-(aminomethyl)-2,3-dihydroxy-heptadecyl]-2,2-dimethyl-propanamide CAS Name: N-[(2S,3S,4R)-1-amino-3,4-dihydroxyoctadecan-2-yl]-2,2-dimethylpropanamide IUPAC Name: N-[(2S,3S,4R)-1-amino-3,4-dihydroxyoctadecan-2-yl]-2,2-dimethylpropanamide Traditional Name: N-[(1S,2S,3R)-1-(aminomethyl)-2,3-dihydroxy-heptadecyl]-2,2-dimethyl-propionamide Formula: C23H48N2O3 MolecularWeight: 400.63882

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H48N2O3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-20(26)21(27)19(18-24)25-22(28)23(2,3)4/h19-21,26-27H,5-18,24H2,1-4H3,(H,25,28)/t19-,20+,21-/m0/s1