[1,2,2-tris(fluoranyl)-7-phosphonooxy-heptan-3-yl] dihydrogen phosphate

Systemtic Name: [1,2,2-tris(fluoranyl)-7-phosphonooxy-heptan-3-yl] dihydrogen phosphate Openeye Name: [5-phosphonooxy-1-(1,1,2-trifluoroethyl)pentyl] dihydrogen phosphate CAS Name: (1,2,2-trifluoro-7-phosphonooxyheptan-3-yl) dihydrogen phosphate IUPAC Name: (1,2,2-trifluoro-7-phosphonooxyheptan-3-yl) dihydrogen phosphate Traditional Name: [5-phosphonooxy-1-(1,1,2-trifluoroethyl)pentyl] dihydrogen phosphate Formula: C7H15F3O8P2 MolecularWeight: 346.131932

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Descriptors Computed from Structure

Canonical SMILES:

C(CCOP(=O)(O)O)CC(C(CF)(F)F)OP(=O)(O)O

Isomeric SMILES

C(CCOP(=O)(O)O)CC(C(CF)(F)F)OP(=O)(O)O

InChI

InChI=1S/C7H15F3O8P2/c8-5-7(9,10)6(18-20(14,15)16)3-1-2-4-17-19(11,12)13/h6H,1-5H2,(H2,11,12,13)(H2,14,15,16)