2-[1-[8-cyclohexyl-6,7-bis(sulfanyl)pentadecan-6-yl]oxypropoxy]-2-oxidanyl-2-phosphoroso-ethanoic acid

Systemtic Name: 2-[1-[8-cyclohexyl-6,7-bis(sulfanyl)pentadecan-6-yl]oxypropoxy]-2-oxidanyl-2-phosphoroso-ethanoic acid Openeye Name: 2-[1-[3-cyclohexyl-1-pentyl-1,2-bis(sulfanyl)decoxy]propoxy]-2-hydroxy-2-phosphoroso-acetic acid CAS Name: 2-[1-(8-cyclohexyl-6,7-dimercaptopentadecan-6-yl)oxypropoxy]-2-hydroxy-2-phosphorosoacetic acid IUPAC Name: 2-[1-[8-cyclohexyl-6,7-bis(sulfanyl)pentadecan-6-yl]oxypropoxy]-2-hydroxy-2-phosphorosoacetic acid Traditional Name: 2-[1-(1-amyl-3-cyclohexyl-1,2-dimercapto-decoxy)propoxy]-2-hydroxy-2-phosphoroso-acetic acid Formula: C26H49O6PS2 MolecularWeight: 552.767421

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(C1CCCCC1)C(C(CCCCC)(OC(CC)OC(C(=O)O)(O)P=O)S)S

Isomeric SMILES

CCCCCCCC(C1CCCCC1)C(C(CCCCC)(OC(CC)OC(C(=O)O)(O)P=O)S)S

InChI

InChI=1S/C26H49O6PS2/c1-4-7-9-10-14-18-21(20-16-12-11-13-17-20)23(34)25(35,19-15-8-5-2)31-22(6-3)32-26(29,33-30)24(27)28/h20-23,29,34-35H,4-19H2,1-3H3,(H,27,28)