tetrasodium [oxidanyl(phosphonato)methyl]-propan-2-yloxy-phosphinate

Systemtic Name: tetrasodium [oxidanyl(phosphonato)methyl]-propan-2-yloxy-phosphinate Openeye Name: tetrasodium [hydroxy(phosphonato)methyl]-isopropoxy-phosphinate CAS Name: tetrasodium [hydroxy(phosphonato)methyl]-propan-2-yloxyphosphinate IUPAC Name: tetrasodium [hydroxy(phosphonato)methyl]-propan-2-yloxyphosphinate Traditional Name: tetrasodium [hydroxy(phosphonato)methyl]-isopropoxy-phosphinate Formula: C16H36Na4O28P8-8 MolecularWeight: 1016.189408

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OP(=O)(C(O)P(=O)([O-])[O-])[O-].CC(C)OP(=O)(C(O)P(=O)([O-])[O-])[O-].CC(C)OP(=O)(C(O)P(=O)([O-])[O-])[O-].CC(C)OP(=O)(C(O)P(=O)([O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

CC(C)OP(=O)(C(O)P(=O)([O-])[O-])[O-].CC(C)OP(=O)(C(O)P(=O)([O-])[O-])[O-].CC(C)OP(=O)(C(O)P(=O)([O-])[O-])[O-].CC(C)OP(=O)(C(O)P(=O)([O-])[O-])[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/4C4H12O7P2.4Na/c4*1-3(2)11-13(9,10)4(5)12(6,7)8;;;;/h4*3-5H,1-2H3,(H,9,10)(H2,6,7,8);;;;/q;;;;4*+1/p-12