N-(4-bromanyl-2-fluoranyl-phenyl)-2-ethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2-ethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2-ethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-2-ethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2-ethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2-ethyl-4-nitro-pyrazole-3-carboxamide Formula: C12H10BrFN4O3 MolecularWeight: 357.135203

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)Br)F

Isomeric SMILES

CCN1C(=C(C=N1)[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)Br)F

InChI

InChI=1S/C12H10BrFN4O3/c1-2-17-11(10(6-15-17)18(20)21)12(19)16-9-4-3-7(13)5-8(9)14/h3-6H,2H2,1H3,(H,16,19)