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

Systemtic Name: N-[2,6-bis(bromanyl)-4-nitro-phenyl]-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Openeye Name: N-(2,6-dibromo-4-nitro-phenyl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide CAS Name: N-(2,6-dibromo-4-nitrophenyl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide IUPAC Name: N-(2,6-dibromo-4-nitrophenyl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Traditional Name: N-(2,6-dibromo-4-nitro-phenyl)-5-(trifluoromethyl)-1H-pyrazole-3-carboxamide Formula: C11H5Br2F3N4O3 MolecularWeight: 457.98561

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Br)NC(=O)C2=NNC(=C2)C(F)(F)F)Br)[N+](=O)[O-]

Isomeric SMILES

C1=C(C=C(C(=C1Br)NC(=O)C2=NNC(=C2)C(F)(F)F)Br)[N+](=O)[O-]

InChI

InChI=1S/C11H5Br2F3N4O3/c12-5-1-4(20(22)23)2-6(13)9(5)17-10(21)7-3-8(19-18-7)11(14,15)16/h1-3H,(H,17,21)(H,18,19)