tetrasodium [oxidanyl(phosphonato)methyl]-pentoxy-phosphinate

Systemtic Name: tetrasodium [oxidanyl(phosphonato)methyl]-pentoxy-phosphinate Openeye Name: tetrasodium [hydroxy(phosphonato)methyl]-pentoxy-phosphinate CAS Name: tetrasodium [hydroxy(phosphonato)methyl]-pentoxyphosphinate IUPAC Name: tetrasodium [hydroxy(phosphonato)methyl]-pentoxyphosphinate Traditional Name: tetrasodium amoxy-[hydroxy(phosphonato)methyl]phosphinate Formula: C24H52Na4O28P8-8 MolecularWeight: 1128.402048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C6H16O7P2.4Na/c4*1-2-3-4-5-13-15(11,12)6(7)14(8,9)10;;;;/h4*6-7H,2-5H2,1H3,(H,11,12)(H2,8,9,10);;;;/q;;;;4*+1/p-12