N-[2,6-bis(bromanyl)-4-nitro-phenyl]-4-chloranyl-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-4-chloranyl-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 4-chloro-N-(2,6-dibromo-4-nitro-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-chloro-N-(2,6-dibromo-4-nitrophenyl)-1-methyl-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 4-chloro-N-(2,6-dibromo-4-nitrophenyl)-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 4-chloro-N-(2,6-dibromo-4-nitro-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C12H6Br2ClF3N4O3 MolecularWeight: 506.45725

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)Cl)C(F)(F)F

Isomeric SMILES

CN1C(=C(C(=N1)C(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br)Cl)C(F)(F)F

InChI

InChI=1S/C12H6Br2ClF3N4O3/c1-21-10(12(16,17)18)7(15)9(20-21)11(23)19-8-5(13)2-4(22(24)25)3-6(8)14/h2-3H,1H3,(H,19,23)