3,7-dihydropurine-2,6-dione; 1H-imidazole

Systemtic Name: 3,7-dihydropurine-2,6-dione; 1H-imidazole Openeye Name: 3,7-dihydropurine-2,6-dione; imidazole CAS Name: 3,7-dihydropurine-2,6-dione; 1H-imidazole IUPAC Name: 3,7-dihydropurine-2,6-dione; 1H-imidazole Traditional Name: glyoxaline; xanthine Formula: C8H8N6O2 MolecularWeight: 220.18812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CN=CN1.C1=NC2=C(N1)C(=O)NC(=O)N2

Isomeric SMILES

C1=CN=CN1.C1=NC2=C(N1)C(=O)NC(=O)N2

InChI

InChI=1S/C5H4N4O2.C3H4N2/c10-4-2-3(7-1-6-2)8-5(11)9-4;1-2-5-3-4-1/h1H,(H3,6,7,8,9,10,11);1-3H,(H,4,5)