N-(4-bromanyl-2-fluoranyl-phenyl)-2-[5-methyl-4-nitro-3-(trifluoromethyl)pyrazol-1-yl]ethanamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-[5-methyl-4-nitro-3-(trifluoromethyl)pyrazol-1-yl]ethanamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-[5-methyl-4-nitro-3-(trifluoromethyl)pyrazol-1-yl]acetamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-[5-methyl-4-nitro-3-(trifluoromethyl)-1-pyrazolyl]acetamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-[5-methyl-4-nitro-3-(trifluoromethyl)pyrazol-1-yl]acetamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-[5-methyl-4-nitro-3-(trifluoromethyl)pyrazol-1-yl]acetamide Formula: C13H9BrF4N4O3 MolecularWeight: 425.133173

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2)Br)F)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC(=O)NC2=C(C=C(C=C2)Br)F)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C13H9BrF4N4O3/c1-6-11(22(24)25)12(13(16,17)18)20-21(6)5-10(23)19-9-3-2-7(14)4-8(9)15/h2-4H,5H2,1H3,(H,19,23)