5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-one

Systemtic Name: 5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-one Openeye Name: 5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-one CAS Name: 5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-one IUPAC Name: 5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-one Traditional Name: 5-(4-nitrophenyl)-1,2-dihydro-1,2,4-triazol-3-one Formula: C8H6N4O3 MolecularWeight: 206.15824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC(=O)NN2)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C2=NC(=O)NN2)[N+](=O)[O-]

InChI

InChI=1S/C8H6N4O3/c13-8-9-7(10-11-8)5-1-3-6(4-2-5)12(14)15/h1-4H,(H2,9,10,11,13)