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1-(3-diethoxyphosphorylpropyl)-3-methyl-7H-purine-2,6-dione

1-(3-diethoxyphosphorylpropyl)-3-methyl-7H-purine-2,6-dione

Systemtic Name:1-(3-diethoxyphosphorylpropyl)-3-methyl-7H-purine-2,6-dione
Openeye Name:1-(3-diethoxyphosphorylpropyl)-3-methyl-7H-purine-2,6-dione
CAS Name:1-(3-diethoxyphosphorylpropyl)-3-methyl-7H-purine-2,6-dione
IUPAC Name:1-(3-diethoxyphosphorylpropyl)-3-methyl-7H-purine-2,6-dione
Traditional Name:1-(3-diethoxyphosphorylpropyl)-3-methyl-7H-purine-2,6-quinone
Formula: C13H21N4O5P
MolecularWeight: 344.303401
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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(CCCN1C(=O)C2=C(N=CN2)N(C1=O)C)OCC


Isomeric SMILES

CCOP(=O)(CCCN1C(=O)C2=C(N=CN2)N(C1=O)C)OCC


InChI

InChI=1S/C13H21N4O5P/c1-4-21-23(20,22-5-2)8-6-7-17-12(18)10-11(15-9-14-10)16(3)13(17)19/h9H,4-8H2,1-3H3,(H,14,15)


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