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2-[2-(6-oxidanylidene-3H-purin-9-yl)ethoxy]butylphosphonic acid

2-[2-(6-oxidanylidene-3H-purin-9-yl)ethoxy]butylphosphonic acid

Systemtic Name:2-[2-(6-oxidanylidene-3H-purin-9-yl)ethoxy]butylphosphonic acid
Openeye Name:2-[2-(6-oxo-3H-purin-9-yl)ethoxy]butylphosphonic acid
CAS Name:2-[2-(6-oxo-3H-purin-9-yl)ethoxy]butylphosphonic acid
IUPAC Name:2-[2-(6-oxo-3H-purin-9-yl)ethoxy]butylphosphonic acid
Traditional Name:2-[2-(6-keto-3H-purin-9-yl)ethoxy]butylphosphonic acid
Formula: C11H17N4O5P
MolecularWeight: 316.250241
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Descriptors Computed from Structure

Canonical SMILES:

CCC(CP(=O)(O)O)OCCN1C=NC2=C1NC=NC2=O


Isomeric SMILES

CCC(CP(=O)(O)O)OCCN1C=NC2=C1NC=NC2=O


InChI

InChI=1S/C11H17N4O5P/c1-2-8(5-21(17,18)19)20-4-3-15-7-14-9-10(15)12-6-13-11(9)16/h6-8H,2-5H2,1H3,(H,12,13,16)(H2,17,18,19)


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