1-(2,5-dimethylpyrazol-3-yl)-2H-1,2,3,4-tetrazol-5-one

Systemtic Name: 1-(2,5-dimethylpyrazol-3-yl)-2H-1,2,3,4-tetrazol-5-one Openeye Name: 1-(2,5-dimethylpyrazol-3-yl)-2H-tetrazol-5-one CAS Name: 1-(2,5-dimethyl-3-pyrazolyl)-2H-tetrazol-5-one IUPAC Name: 1-(2,5-dimethylpyrazol-3-yl)-2H-tetrazol-5-one Traditional Name: 1-(2,5-dimethylpyrazol-3-yl)-2H-tetrazol-5-one Formula: C6H8N6O MolecularWeight: 180.16732

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1)N2C(=O)N=NN2)C

Isomeric SMILES

CC1=NN(C(=C1)N2C(=O)N=NN2)C

InChI

InChI=1S/C6H8N6O/c1-4-3-5(11(2)8-4)12-6(13)7-9-10-12/h3H,1-2H3,(H,7,10,13)