[1-heptylsulfanyl-3-[2-hydroxyethyloxy(oxidanyl)phosphoryl]oxy-propan-2-yl]oxy-octyl-phosphinic acid

Systemtic Name: [1-heptylsulfanyl-3-[2-hydroxyethyloxy(oxidanyl)phosphoryl]oxy-propan-2-yl]oxy-octyl-phosphinic acid Openeye Name: [1-(heptylsulfanylmethyl)-2-[hydroxy(2-hydroxyethoxy)phosphoryl]oxy-ethoxy]-octyl-phosphinic acid CAS Name: [1-(heptylthio)-3-[hydroxy(2-hydroxyethoxy)phosphoryl]oxypropan-2-yl]oxy-octylphosphinic acid IUPAC Name: [1-heptylsulfanyl-3-[hydroxy(2-hydroxyethoxy)phosphoryl]oxypropan-2-yl]oxy-octylphosphinic acid Traditional Name: [1-[(heptylthio)methyl]-2-[hydroxy(2-hydroxyethoxy)phosphoryl]oxy-ethoxy]-octyl-phosphinic acid Formula: C20H44O8P2S MolecularWeight: 506.571082

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCP(=O)(O)OC(COP(=O)(O)OCCO)CSCCCCCCC

Isomeric SMILES

CCCCCCCCP(=O)(O)OC(COP(=O)(O)OCCO)CSCCCCCCC

InChI

InChI=1S/C20H44O8P2S/c1-3-5-7-9-10-12-16-29(22,23)28-20(18-27-30(24,25)26-15-14-21)19-31-17-13-11-8-6-4-2/h20-21H,3-19H2,1-2H3,(H,22,23)(H,24,25)