3-[2,5-bis(fluoranyl)-4-nitro-phenyl]-4-bromanyl-1-methyl-5-(trifluoromethyl)pyrazole

Systemtic Name: 3-[2,5-bis(fluoranyl)-4-nitro-phenyl]-4-bromanyl-1-methyl-5-(trifluoromethyl)pyrazole Openeye Name: 4-bromo-3-(2,5-difluoro-4-nitro-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole CAS Name: 4-bromo-3-(2,5-difluoro-4-nitrophenyl)-1-methyl-5-(trifluoromethyl)pyrazole IUPAC Name: 4-bromo-3-(2,5-difluoro-4-nitrophenyl)-1-methyl-5-(trifluoromethyl)pyrazole Traditional Name: 4-bromo-3-(2,5-difluoro-4-nitro-phenyl)-1-methyl-5-(trifluoromethyl)pyrazole Formula: C11H5BrF5N3O2 MolecularWeight: 386.072316

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C(=N1)C2=CC(=C(C=C2F)[N+](=O)[O-])F)Br)C(F)(F)F

Isomeric SMILES

CN1C(=C(C(=N1)C2=CC(=C(C=C2F)[N+](=O)[O-])F)Br)C(F)(F)F

InChI

InChI=1S/C11H5BrF5N3O2/c1-19-10(11(15,16)17)8(12)9(18-19)4-2-6(14)7(20(21)22)3-5(4)13/h2-3H,1H3