4-bromanyl-1-methyl-N-(2-methyl-4-nitro-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-1-methyl-N-(2-methyl-4-nitro-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-1-methyl-N-(2-methyl-4-nitro-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-bromo-1-methyl-N-(2-methyl-4-nitrophenyl)-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-1-methyl-N-(2-methyl-4-nitrophenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-1-methyl-N-(2-methyl-4-nitro-phenyl)-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C13H10BrF3N4O3 MolecularWeight: 407.14271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=NN(C(=C2Br)C(F)(F)F)C

Isomeric SMILES

CC1=C(C=CC(=C1)[N+](=O)[O-])NC(=O)C2=NN(C(=C2Br)C(F)(F)F)C

InChI

InChI=1S/C13H10BrF3N4O3/c1-6-5-7(21(23)24)3-4-8(6)18-12(22)10-9(14)11(13(15,16)17)20(2)19-10/h3-5H,1-2H3,(H,18,22)