2-(6-oxidanylidene-3H-purin-9-yl)ethoxymethylphosphonic acid

Systemtic Name: 2-(6-oxidanylidene-3H-purin-9-yl)ethoxymethylphosphonic acid Openeye Name: 2-(6-oxo-3H-purin-9-yl)ethoxymethylphosphonic acid CAS Name: 2-(6-oxo-3H-purin-9-yl)ethoxymethylphosphonic acid IUPAC Name: 2-(6-oxo-3H-purin-9-yl)ethoxymethylphosphonic acid Traditional Name: 2-(6-keto-3H-purin-9-yl)ethoxymethylphosphonic acid Formula: C8H11N4O5P MolecularWeight: 274.170501

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Descriptors Computed from Structure

Canonical SMILES:

C1=NC(=O)C2=C(N1)N(C=N2)CCOCP(=O)(O)O

Isomeric SMILES

C1=NC(=O)C2=C(N1)N(C=N2)CCOCP(=O)(O)O

InChI

InChI=1S/C8H11N4O5P/c13-8-6-7(9-3-10-8)12(4-11-6)1-2-17-5-18(14,15)16/h3-4H,1-2,5H2,(H,9,10,13)(H2,14,15,16)