(3E)-3-(4-nitroimidazol-2-ylidene)-1,2-dihydropyrazolo[3,4-d]pyrimidine

Systemtic Name: (3E)-3-(4-nitroimidazol-2-ylidene)-1,2-dihydropyrazolo[3,4-d]pyrimidine Openeye Name: (3E)-3-(4-nitroimidazol-2-ylidene)-1,2-dihydropyrazolo[3,4-d]pyrimidine CAS Name: (3E)-3-(4-nitro-2-imidazolylidene)-1,2-dihydropyrazolo[3,4-d]pyrimidine IUPAC Name: (3E)-3-(4-nitroimidazol-2-ylidene)-1,2-dihydropyrazolo[3,4-d]pyrimidine Traditional Name: (3E)-3-(4-nitroimidazol-2-ylidene)-1,2-dihydropyrazolo[3,4-d]pyrimidine Formula: C8H5N7O2 MolecularWeight: 231.171

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C2C(=C3N=CC(=N3)[N+](=O)[O-])NNC2=NC=N1

Isomeric SMILES

C1=C2/C(=C\3/N=CC(=N3)[N+](=O)[O-])/NNC2=NC=N1

InChI

InChI=1S/C8H5N7O2/c16-15(17)5-2-10-8(12-5)6-4-1-9-3-11-7(4)14-13-6/h1-3,13H,(H,9,11,14)/b8-6+