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

Systemtic Name: 2-(4-nitrophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one Openeye Name: 2-(4-nitrophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one CAS Name: 2-(4-nitrophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one IUPAC Name: 2-(4-nitrophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one Traditional Name: 2-(4-nitrophenyl)-5-(trifluoromethyl)-1H-1,2,4-triazol-3-one Formula: C9H5F3N4O3 MolecularWeight: 274.15621

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)N=C(N2)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)N=C(N2)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C9H5F3N4O3/c10-9(11,12)7-13-8(17)15(14-7)5-1-3-6(4-2-5)16(18)19/h1-4H,(H,13,14,17)