4-bromanyl-2-methyl-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-methyl-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-2-methyl-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-bromo-2-methyl-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-methyl-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-2-methyl-N-[3-nitro-5-(2,3,5-trimethylphenoxy)phenyl]-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C21H18BrF3N4O4 MolecularWeight: 527.29123

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(C(=NN3C)C(F)(F)F)Br)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=CC(=CC(=C2)[N+](=O)[O-])NC(=O)C3=C(C(=NN3C)C(F)(F)F)Br)C)C

InChI

InChI=1S/C21H18BrF3N4O4/c1-10-5-11(2)12(3)16(6-10)33-15-8-13(7-14(9-15)29(31)32)26-20(30)18-17(22)19(21(23,24)25)27-28(18)4/h5-9H,1-4H3,(H,26,30)