4-bromanyl-2-methyl-N-(4-nitro-2-oxidanyl-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-methyl-N-(4-nitro-2-oxidanyl-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-N-(2-hydroxy-4-nitro-phenyl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-bromo-N-(2-hydroxy-4-nitrophenyl)-2-methyl-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-(2-hydroxy-4-nitrophenyl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-N-(2-hydroxy-4-nitro-phenyl)-2-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C12H8BrF3N4O4 MolecularWeight: 409.11553

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(F)(F)F)Br)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O

Isomeric SMILES

CN1C(=C(C(=N1)C(F)(F)F)Br)C(=O)NC2=C(C=C(C=C2)[N+](=O)[O-])O

InChI

InChI=1S/C12H8BrF3N4O4/c1-19-9(8(13)10(18-19)12(14,15)16)11(22)17-6-3-2-5(20(23)24)4-7(6)21/h2-4,21H,1H3,(H,17,22)