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2-[2,6-bis(azanyl)-5-(cyanomethyl)pyrimidin-4-yl]oxyethoxymethylphosphonic acid

2-[2,6-bis(azanyl)-5-(cyanomethyl)pyrimidin-4-yl]oxyethoxymethylphosphonic acid

Systemtic Name:2-[2,6-bis(azanyl)-5-(cyanomethyl)pyrimidin-4-yl]oxyethoxymethylphosphonic acid
Openeye Name:2-[2,6-diamino-5-(cyanomethyl)pyrimidin-4-yl]oxyethoxymethylphosphonic acid
CAS Name:2-[[2,6-diamino-5-(cyanomethyl)-4-pyrimidinyl]oxy]ethoxymethylphosphonic acid
IUPAC Name:2-[2,6-diamino-5-(cyanomethyl)pyrimidin-4-yl]oxyethoxymethylphosphonic acid
Traditional Name:2-[2,6-diamino-5-(cyanomethyl)pyrimidin-4-yl]oxyethoxymethylphosphonic acid
Formula: C9H14N5O5P
MolecularWeight: 303.211721
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Descriptors Computed from Structure

Canonical SMILES:

C(COC1=NC(=NC(=C1CC#N)N)N)OCP(=O)(O)O


Isomeric SMILES

C(COC1=NC(=NC(=C1CC#N)N)N)OCP(=O)(O)O


InChI

InChI=1S/C9H14N5O5P/c10-2-1-6-7(11)13-9(12)14-8(6)19-4-3-18-5-20(15,16)17/h1,3-5H2,(H2,15,16,17)(H4,11,12,13,14)


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