2-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)ethoxymethylphosphonic acid

Systemtic Name: 2-(4-azanylpyrazolo[3,4-d]pyrimidin-1-yl)ethoxymethylphosphonic acid Openeye Name: 2-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)ethoxymethylphosphonic acid CAS Name: 2-(4-amino-1-pyrazolo[3,4-d]pyrimidinyl)ethoxymethylphosphonic acid IUPAC Name: 2-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)ethoxymethylphosphonic acid Traditional Name: 2-(4-aminopyrazolo[3,4-d]pyrimidin-1-yl)ethoxymethylphosphonic acid Formula: C8H12N5O4P MolecularWeight: 273.185741

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Descriptors Computed from Structure

Canonical SMILES:

C1=NN(C2=C1C(=NC=N2)N)CCOCP(=O)(O)O

Isomeric SMILES

C1=NN(C2=C1C(=NC=N2)N)CCOCP(=O)(O)O

InChI

InChI=1S/C8H12N5O4P/c9-7-6-3-12-13(8(6)11-4-10-7)1-2-17-5-18(14,15)16/h3-4H,1-2,5H2,(H2,9,10,11)(H2,14,15,16)