N-(4-bromanyl-2-fluoranyl-phenyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-(4-bromanyl-2-fluoranyl-phenyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-(4-bromo-2-fluoro-phenyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-(4-bromo-2-fluorophenyl)-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-(4-bromo-2-fluorophenyl)-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(4-bromo-2-fluoro-phenyl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C12H10BrFN4O3 MolecularWeight: 357.135203

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)Br)F)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=C(C=C(C=C2)Br)F)C

InChI

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