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1-(6-oxidanylidenepurin-2-yl)ethoxymethylphosphonic acid

1-(6-oxidanylidenepurin-2-yl)ethoxymethylphosphonic acid

Systemtic Name:1-(6-oxidanylidenepurin-2-yl)ethoxymethylphosphonic acid
Openeye Name:1-(6-oxopurin-2-yl)ethoxymethylphosphonic acid
CAS Name:1-(6-oxo-2-purinyl)ethoxymethylphosphonic acid
IUPAC Name:1-(6-oxopurin-2-yl)ethoxymethylphosphonic acid
Traditional Name:1-(6-ketopurin-2-yl)ethoxymethylphosphonic acid
Formula: C8H9N4O5P
MolecularWeight: 272.154621
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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=NC=NC2=N1)OCP(=O)(O)O


Isomeric SMILES

CC(C1=NC(=O)C2=NC=NC2=N1)OCP(=O)(O)O


InChI

InChI=1S/C8H9N4O5P/c1-4(17-3-18(14,15)16)6-11-7-5(8(13)12-6)9-2-10-7/h2,4H,3H2,1H3,(H2,14,15,16)


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