disodium 1-dimethoxyphosphoryl-22-phosphonato-docosane-1,22-dione

Systemtic Name: disodium 1-dimethoxyphosphoryl-22-phosphonato-docosane-1,22-dione Openeye Name: disodium 1-dimethoxyphosphoryl-22-phosphonato-docosane-1,22-dione CAS Name: disodium 1-dimethoxyphosphoryl-22-phosphonatodocosane-1,22-dione IUPAC Name: disodium 1-dimethoxyphosphoryl-22-phosphonatodocosane-1,22-dione Traditional Name: disodium 1-dimethoxyphosphoryl-22-phosphonato-docosane-1,22-dione Formula: C24H46Na2O8P2 MolecularWeight: 570.544302

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Descriptors Computed from Structure

Canonical SMILES:

COP(=O)(C(=O)CCCCCCCCCCCCCCCCCCCCC(=O)P(=O)([O-])[O-])OC.[Na+].[Na+]

Isomeric SMILES

COP(=O)(C(=O)CCCCCCCCCCCCCCCCCCCCC(=O)P(=O)([O-])[O-])OC.[Na+].[Na+]

InChI

InChI=1S/C24H48O8P2.2Na/c1-31-34(30,32-2)24(26)22-20-18-16-14-12-10-8-6-4-3-5-7-9-11-13-15-17-19-21-23(25)33(27,28)29;;/h3-22H2,1-2H3,(H2,27,28,29);;/q;2*+1/p-2