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1-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)oxy]but-3-enylphosphonic acid

1-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)oxy]but-3-enylphosphonic acid

Systemtic Name:1-[(2-azanyl-6-oxidanylidene-7,8-dihydro-3H-purin-9-yl)oxy]but-3-enylphosphonic acid
Openeye Name:1-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)oxy]but-3-enylphosphonic acid
CAS Name:1-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)oxy]but-3-enylphosphonic acid
IUPAC Name:1-[(2-amino-6-oxo-7,8-dihydro-3H-purin-9-yl)oxy]but-3-enylphosphonic acid
Traditional Name:1-[(2-amino-6-keto-7,8-dihydro-3H-purin-9-yl)oxy]but-3-enylphosphonic acid
Formula: C9H14N5O5P
MolecularWeight: 303.211721
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Descriptors Computed from Structure

Canonical SMILES:

C=CCC(ON1CNC2=C1NC(=NC2=O)N)P(=O)(O)O


Isomeric SMILES

C=CCC(ON1CNC2=C1NC(=NC2=O)N)P(=O)(O)O


InChI

InChI=1S/C9H14N5O5P/c1-2-3-5(20(16,17)18)19-14-4-11-6-7(14)12-9(10)13-8(6)15/h2,5,11H,1,3-4H2,(H2,16,17,18)(H3,10,12,13,15)


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