3-(trifluoromethyl)-1H-pyrazole-4,5-dione

Systemtic Name: 3-(trifluoromethyl)-1H-pyrazole-4,5-dione Openeye Name: 3-(trifluoromethyl)-1H-pyrazole-4,5-dione CAS Name: 3-(trifluoromethyl)-1H-pyrazole-4,5-dione IUPAC Name: 3-(trifluoromethyl)-1H-pyrazole-4,5-dione Traditional Name: 5-(trifluoromethyl)-2-pyrazoline-3,4-quinone Formula: C4HF3N2O2 MolecularWeight: 166.05815

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Descriptors Computed from Structure

Canonical SMILES:

C1(=O)C(=NNC1=O)C(F)(F)F

Isomeric SMILES

C1(=O)C(=NNC1=O)C(F)(F)F

InChI

InChI=1S/C4HF3N2O2/c5-4(6,7)2-1(10)3(11)9-8-2/h(H,9,10,11)