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

Systemtic Name: 4-bromanyl-N-(4-ethoxy-2-nitro-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 4-bromo-N-(4-ethoxy-2-nitro-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 4-bromo-N-(4-ethoxy-2-nitrophenyl)-1-methyl-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 4-bromo-N-(4-ethoxy-2-nitrophenyl)-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 4-bromo-N-(4-ethoxy-2-nitro-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C14H12BrF3N4O4 MolecularWeight: 437.16869

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C(=C2Br)C(F)(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC(=C(C=C1)NC(=O)C2=NN(C(=C2Br)C(F)(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C14H12BrF3N4O4/c1-3-26-7-4-5-8(9(6-7)22(24)25)19-13(23)11-10(15)12(14(16,17)18)21(2)20-11/h4-6H,3H2,1-2H3,(H,19,23)