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

Systemtic Name: 4-methyl-3-(4-nitrophenyl)-1H-1,2,4-triazol-5-one Openeye Name: 4-methyl-3-(4-nitrophenyl)-1H-1,2,4-triazol-5-one CAS Name: 4-methyl-3-(4-nitrophenyl)-1H-1,2,4-triazol-5-one IUPAC Name: 4-methyl-3-(4-nitrophenyl)-1H-1,2,4-triazol-5-one Traditional Name: 4-methyl-3-(4-nitrophenyl)-1H-1,2,4-triazol-5-one Formula: C9H8N4O3 MolecularWeight: 220.18482

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NNC1=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CN1C(=NNC1=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C9H8N4O3/c1-12-8(10-11-9(12)14)6-2-4-7(5-3-6)13(15)16/h2-5H,1H3,(H,11,14)