7-(6-azanyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)heptylphosphonic acid

Systemtic Name: 7-(6-azanyl-4-oxidanylidene-2H-pyrazolo[3,4-d]pyrimidin-1-yl)heptylphosphonic acid Openeye Name: 7-(6-amino-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)heptylphosphonic acid CAS Name: 7-(6-amino-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)heptylphosphonic acid IUPAC Name: 7-(6-amino-4-oxo-2H-pyrazolo[3,4-d]pyrimidin-1-yl)heptylphosphonic acid Traditional Name: 7-(6-amino-4-keto-2H-pyrazolo[3,4-d]pyrimidin-1-yl)heptylphosphonic acid Formula: C12H20N5O4P MolecularWeight: 329.292061

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Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=NC(=NC2=O)N)N(N1)CCCCCCCP(=O)(O)O

Isomeric SMILES

C1=C2C(=NC(=NC2=O)N)N(N1)CCCCCCCP(=O)(O)O

InChI

InChI=1S/C12H20N5O4P/c13-12-15-10-9(11(18)16-12)8-14-17(10)6-4-2-1-3-5-7-22(19,20)21/h8,14H,1-7H2,(H2,13,16,18)(H2,19,20,21)