3-[3-(octadecylcarbamoyloxy)-2-oxidanyl-propyl]sulfanylpropanoic acid

Systemtic Name: 3-[3-(octadecylcarbamoyloxy)-2-oxidanyl-propyl]sulfanylpropanoic acid Openeye Name: 3-[2-hydroxy-3-(octadecylcarbamoyloxy)propyl]sulfanylpropanoic acid CAS Name: 3-[[2-hydroxy-3-[(octadecylamino)-oxomethoxy]propyl]thio]propanoic acid IUPAC Name: 3-[2-hydroxy-3-(octadecylcarbamoyloxy)propyl]sulfanylpropanoic acid Traditional Name: 3-[[2-hydroxy-3-(stearylcarbamoyloxy)propyl]thio]propionic acid Formula: C25H49NO5S MolecularWeight: 475.72526

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)OCC(CSCCC(=O)O)O

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)OCC(CSCCC(=O)O)O

InChI

InChI=1S/C25H49NO5S/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-26-25(30)31-21-23(27)22-32-20-18-24(28)29/h23,27H,2-22H2,1H3,(H,26,30)(H,28,29)