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

Systemtic Name: [1-heptylsulfanyl-3-[methyl(oxidanyl)phosphoryl]oxy-propan-2-yl]oxy-octyl-phosphinic acid Openeye Name: [3-heptylsulfanyl-2-[hydroxy(octyl)phosphoryl]oxy-propoxy]-methyl-phosphinic acid CAS Name: [1-(heptylthio)-3-[hydroxy(methyl)phosphoryl]oxypropan-2-yl]oxy-octylphosphinic acid IUPAC Name: [1-heptylsulfanyl-3-[hydroxy(methyl)phosphoryl]oxypropan-2-yl]oxy-octylphosphinic acid Traditional Name: [3-(heptylthio)-2-[hydroxy(octyl)phosphoryl]oxy-propoxy]-methyl-phosphinic acid Formula: C19H42O6P2S MolecularWeight: 460.545702

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H42O6P2S/c1-4-6-8-10-11-13-15-27(22,23)25-19(17-24-26(3,20)21)18-28-16-14-12-9-7-5-2/h19H,4-18H2,1-3H3,(H,20,21)(H,22,23)