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

Systemtic Name: 2-[4-(dimethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethoxymethylphosphonic acid Openeye Name: 2-[4-(dimethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethoxymethylphosphonic acid CAS Name: 2-[4-(dimethylamino)-1-pyrazolo[3,4-d]pyrimidinyl]ethoxymethylphosphonic acid IUPAC Name: 2-[4-(dimethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethoxymethylphosphonic acid Traditional Name: 2-[4-(dimethylamino)pyrazolo[3,4-d]pyrimidin-1-yl]ethoxymethylphosphonic acid Formula: C10H16N5O4P MolecularWeight: 301.238901

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=NC=NC2=C1C=NN2CCOCP(=O)(O)O

Isomeric SMILES

CN(C)C1=NC=NC2=C1C=NN2CCOCP(=O)(O)O

InChI

InChI=1S/C10H16N5O4P/c1-14(2)9-8-5-13-15(10(8)12-6-11-9)3-4-19-7-20(16,17)18/h5-6H,3-4,7H2,1-2H3,(H2,16,17,18)