[(2R)-1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-octylsulfanyl-propan-2-yl]oxy-heptyl-phosphinic acid

Systemtic Name: [(2R)-1-[2-azanylethoxy(oxidanyl)phosphoryl]oxy-3-octylsulfanyl-propan-2-yl]oxy-heptyl-phosphinic acid Openeye Name: [(1R)-1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-octylsulfanyl-ethoxy]-heptyl-phosphinic acid CAS Name: [(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-(octylthio)propan-2-yl]oxy-heptylphosphinic acid IUPAC Name: [(2R)-1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-octylsulfanylpropan-2-yl]oxy-heptylphosphinic acid Traditional Name: [(1R)-1-[[2-aminoethoxy(hydroxy)phosphoryl]oxymethyl]-2-(octylthio)ethoxy]-heptyl-phosphinic acid Formula: C20H45NO7P2S MolecularWeight: 505.586322

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCSCC(COP(=O)(O)OCCN)OP(=O)(CCCCCCC)O

Isomeric SMILES

CCCCCCCCSC[C@@H](COP(=O)(O)OCCN)OP(=O)(CCCCCCC)O

InChI

InChI=1S/C20H45NO7P2S/c1-3-5-7-9-11-13-17-31-19-20(18-27-30(24,25)26-15-14-21)28-29(22,23)16-12-10-8-6-4-2/h20H,3-19,21H2,1-2H3,(H,22,23)(H,24,25)/t20-/m1/s1