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

Systemtic Name: [1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-heptylsulfanyl-propan-2-yl]oxy-octyl-phosphinic acid Openeye Name: [1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-heptylsulfanyl-ethoxy]-octyl-phosphinic acid CAS Name: [1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-(heptylthio)propan-2-yl]oxy-octylphosphinic acid IUPAC Name: [1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-heptylsulfanylpropan-2-yl]oxy-octylphosphinic acid Traditional Name: [1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-(heptylthio)ethoxy]-octyl-phosphinic acid Formula: C20H45NO7P2S MolecularWeight: 505.586322

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H45NO7P2S/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/h20H,3-19,21H2,1-2H3,(H,22,23)(H,24,25)