disodium [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]oxymethylphosphonic acid

Systemtic Name: disodium [5-(4-azanyl-2-oxidanylidene-pyrimidin-1-yl)-3-oxidanyl-oxolan-2-yl]oxymethylphosphonic acid Openeye Name: disodium [5-(4-amino-2-oxo-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]oxymethylphosphonic acid CAS Name: disodium [5-(4-amino-2-oxo-1-pyrimidinyl)-3-hydroxy-2-oxolanyl]oxymethylphosphonic acid IUPAC Name: disodium [5-(4-amino-2-oxopyrimidin-1-yl)-3-hydroxyoxolan-2-yl]oxymethylphosphonic acid Traditional Name: disodium [5-(4-amino-2-keto-pyrimidin-1-yl)-3-hydroxy-tetrahydrofuran-2-yl]oxymethylphosphonic acid Formula: C9H14N3Na2O7P+2 MolecularWeight: 353.176661

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(OC1N2C=CC(=NC2=O)N)OCP(=O)(O)O)O.[Na+].[Na+]

Isomeric SMILES

C1C(C(OC1N2C=CC(=NC2=O)N)OCP(=O)(O)O)O.[Na+].[Na+]

InChI

InChI=1S/C9H14N3O7P.2Na/c10-6-1-2-12(9(14)11-6)7-3-5(13)8(19-7)18-4-20(15,16)17;;/h1-2,5,7-8,13H,3-4H2,(H2,10,11,14)(H2,15,16,17);;/q;2*+1