tetrasodium nonoxy-[oxidanyl(phosphonato)methyl]phosphinate

Systemtic Name: tetrasodium nonoxy-[oxidanyl(phosphonato)methyl]phosphinate Openeye Name: tetrasodium [hydroxy(phosphonato)methyl]-nonoxy-phosphinate CAS Name: tetrasodium [hydroxy(phosphonato)methyl]-nonoxyphosphinate IUPAC Name: tetrasodium [hydroxy(phosphonato)methyl]-nonoxyphosphinate Traditional Name: tetrasodium [hydroxy(phosphonato)methyl]-nonoxy-phosphinate Formula: C40H84Na4O28P8-8 MolecularWeight: 1352.827328

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C10H24O7P2.4Na/c4*1-2-3-4-5-6-7-8-9-17-19(15,16)10(11)18(12,13)14;;;;/h4*10-11H,2-9H2,1H3,(H,15,16)(H2,12,13,14);;;;/q;;;;4*+1/p-12