2-(3-cyano-4-fluoranyl-phenyl)-N-(1-methylimidazol-2-yl)-4-nitro-5-(trifluoromethyl)pyrazole-3-carboxamide

Systemtic Name: 2-(3-cyano-4-fluoranyl-phenyl)-N-(1-methylimidazol-2-yl)-4-nitro-5-(trifluoromethyl)pyrazole-3-carboxamide Openeye Name: 2-(3-cyano-4-fluoro-phenyl)-N-(1-methylimidazol-2-yl)-4-nitro-5-(trifluoromethyl)pyrazole-3-carboxamide CAS Name: 2-(3-cyano-4-fluorophenyl)-N-(1-methyl-2-imidazolyl)-4-nitro-5-(trifluoromethyl)-3-pyrazolecarboxamide IUPAC Name: 2-(3-cyano-4-fluorophenyl)-N-(1-methylimidazol-2-yl)-4-nitro-5-(trifluoromethyl)pyrazole-3-carboxamide Traditional Name: 2-(3-cyano-4-fluoro-phenyl)-N-(1-methylimidazol-2-yl)-4-nitro-5-(trifluoromethyl)pyrazole-3-carboxamide Formula: C16H9F4N7O3 MolecularWeight: 423.281373

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=CN=C1NC(=O)C2=C(C(=NN2C3=CC(=C(C=C3)F)C#N)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=CN=C1NC(=O)C2=C(C(=NN2C3=CC(=C(C=C3)F)C#N)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H9F4N7O3/c1-25-5-4-22-15(25)23-14(28)12-11(27(29)30)13(16(18,19)20)24-26(12)9-2-3-10(17)8(6-9)7-21/h2-6H,1H3,(H,22,23,28)