tetrasodium decoxy-[oxidanyl(phosphonato)methyl]phosphinate

Systemtic Name: tetrasodium decoxy-[oxidanyl(phosphonato)methyl]phosphinate Openeye Name: tetrasodium decoxy-[hydroxy(phosphonato)methyl]phosphinate CAS Name: tetrasodium decoxy-[hydroxy(phosphonato)methyl]phosphinate IUPAC Name: tetrasodium decoxy-[hydroxy(phosphonato)methyl]phosphinate Traditional Name: tetrasodium decoxy-[hydroxy(phosphonato)methyl]phosphinate Formula: C44H92Na4O28P8-8 MolecularWeight: 1408.933648

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/4C11H26O7P2.4Na/c4*1-2-3-4-5-6-7-8-9-10-18-20(16,17)11(12)19(13,14)15;;;;/h4*11-12H,2-10H2,1H3,(H,16,17)(H2,13,14,15);;;;/q;;;;4*+1/p-12