4-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3,5-dione

Systemtic Name: 4-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3,5-dione Openeye Name: 4-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3,5-dione CAS Name: 4-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3,5-dione IUPAC Name: 4-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3,5-dione Traditional Name: 4-[3,5-bis(trifluoromethyl)phenyl]-1,2,4-triazole-3,5-quinone Formula: C10H3F6N3O2 MolecularWeight: 311.140139

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C=C1C(F)(F)F)N2C(=O)N=NC2=O)C(F)(F)F

Isomeric SMILES

C1=C(C=C(C=C1C(F)(F)F)N2C(=O)N=NC2=O)C(F)(F)F

InChI

InChI=1S/C10H3F6N3O2/c11-9(12,13)4-1-5(10(14,15)16)3-6(2-4)19-7(20)17-18-8(19)21/h1-3H