trisodium 2-[bis(2-phosphonatooxyethyl)amino]ethyl phosphate

Systemtic Name: trisodium 2-[bis(2-phosphonatooxyethyl)amino]ethyl phosphate Openeye Name: trisodium 2-[bis(2-phosphonatooxyethyl)amino]ethyl phosphate CAS Name: trisodium 2-[bis(2-phosphonatooxyethyl)amino]ethyl phosphate IUPAC Name: trisodium 2-[bis(2-phosphonatooxyethyl)amino]ethyl phosphate Traditional Name: trisodium 2-[bis(2-phosphatoethyl)amino]ethyl phosphate Formula: C6H12NNa3O12P3-3 MolecularWeight: 452.049573

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Descriptors Computed from Structure

Canonical SMILES:

C(COP(=O)([O-])[O-])N(CCOP(=O)([O-])[O-])CCOP(=O)([O-])[O-].[Na+].[Na+].[Na+]

Isomeric SMILES

C(COP(=O)([O-])[O-])N(CCOP(=O)([O-])[O-])CCOP(=O)([O-])[O-].[Na+].[Na+].[Na+]

InChI

InChI=1S/C6H18NO12P3.3Na/c8-20(9,10)17-4-1-7(2-5-18-21(11,12)13)3-6-19-22(14,15)16;;;/h1-6H2,(H2,8,9,10)(H2,11,12,13)(H2,14,15,16);;;/q;3*+1/p-6