5-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1H-1,2,4-triazole

Systemtic Name: 5-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1H-1,2,4-triazole Openeye Name: 5-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1H-1,2,4-triazole CAS Name: 5-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1H-1,2,4-triazole IUPAC Name: 5-(3,5-dimethyl-4-nitropyrazol-1-yl)-1H-1,2,4-triazole Traditional Name: 5-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1H-1,2,4-triazole Formula: C7H8N6O2 MolecularWeight: 208.17742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=NC=NN2)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1C2=NC=NN2)C)[N+](=O)[O-]

InChI

InChI=1S/C7H8N6O2/c1-4-6(13(14)15)5(2)12(11-4)7-8-3-9-10-7/h3H,1-2H3,(H,8,9,10)