3,6-bis(azanyl)-5-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 3,6-bis(azanyl)-5-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 3,6-diamino-5-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 3,6-diamino-5-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one IUPAC Name: 3,6-diamino-5-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 3,6-diamino-5-(4-nitrophenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one Formula: C11H9N7O3 MolecularWeight: 287.23426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C3=C(NN=C3N=C2N)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C3=C(NN=C3N=C2N)N)[N+](=O)[O-]

InChI

InChI=1S/C11H9N7O3/c12-8-7-9(16-15-8)14-11(13)17(10(7)19)5-1-3-6(4-2-5)18(20)21/h1-4H,(H5,12,13,14,15,16)