2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[3-(trifluoromethyl)phenyl]ethanone

Systemtic Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[3-(trifluoromethyl)phenyl]ethanone Openeye Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[3-(trifluoromethyl)phenyl]ethanone CAS Name: 2-(3,5-dimethyl-4-nitro-1-pyrazolyl)-1-[3-(trifluoromethyl)phenyl]ethanone IUPAC Name: 2-(3,5-dimethyl-4-nitropyrazol-1-yl)-1-[3-(trifluoromethyl)phenyl]ethanone Traditional Name: 2-(3,5-dimethyl-4-nitro-pyrazol-1-yl)-1-[3-(trifluoromethyl)phenyl]ethanone Formula: C14H12F3N3O3 MolecularWeight: 327.25859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)C2=CC(=CC=C2)C(F)(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)C2=CC(=CC=C2)C(F)(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C14H12F3N3O3/c1-8-13(20(22)23)9(2)19(18-8)7-12(21)10-4-3-5-11(6-10)14(15,16)17/h3-6H,7H2,1-2H3