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2-(6-piperidin-1-ylpurin-9-yl)ethoxymethylphosphonic acid

2-(6-piperidin-1-ylpurin-9-yl)ethoxymethylphosphonic acid

Systemtic Name:2-(6-piperidin-1-ylpurin-9-yl)ethoxymethylphosphonic acid
Openeye Name:2-[6-(1-piperidyl)purin-9-yl]ethoxymethylphosphonic acid
CAS Name:2-[6-(1-piperidinyl)-9-purinyl]ethoxymethylphosphonic acid
IUPAC Name:2-(6-piperidin-1-ylpurin-9-yl)ethoxymethylphosphonic acid
Traditional Name:2-(6-piperidinopurin-9-yl)ethoxymethylphosphonic acid
Formula: C13H20N5O4P
MolecularWeight: 341.302761
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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=NC3=C2N=CN3CCOCP(=O)(O)O


Isomeric SMILES

C1CCN(CC1)C2=NC=NC3=C2N=CN3CCOCP(=O)(O)O


InChI

InChI=1S/C13H20N5O4P/c19-23(20,21)10-22-7-6-18-9-16-11-12(14-8-15-13(11)18)17-4-2-1-3-5-17/h8-9H,1-7,10H2,(H2,19,20,21)


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