5-imidazol-1-yl-1-methyl-3-nitro-1,2,4-triazole

Systemtic Name: 5-imidazol-1-yl-1-methyl-3-nitro-1,2,4-triazole Openeye Name: 5-imidazol-1-yl-1-methyl-3-nitro-1,2,4-triazole CAS Name: 5-(1-imidazolyl)-1-methyl-3-nitro-1,2,4-triazole IUPAC Name: 5-imidazol-1-yl-1-methyl-3-nitro-1,2,4-triazole Traditional Name: 5-imidazol-1-yl-1-methyl-3-nitro-1,2,4-triazole Formula: C6H6N6O2 MolecularWeight: 194.15084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)[N+](=O)[O-])N2C=CN=C2

Isomeric SMILES

CN1C(=NC(=N1)[N+](=O)[O-])N2C=CN=C2

InChI

InChI=1S/C6H6N6O2/c1-10-6(11-3-2-7-4-11)8-5(9-10)12(13)14/h2-4H,1H3