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

Systemtic Name: 4-bromanyl-3,5-dimethyl-1-[2-nitro-4-(trifluoromethyl)phenyl]pyrazole Openeye Name: 4-bromo-3,5-dimethyl-1-[2-nitro-4-(trifluoromethyl)phenyl]pyrazole CAS Name: 4-bromo-3,5-dimethyl-1-[2-nitro-4-(trifluoromethyl)phenyl]pyrazole IUPAC Name: 4-bromo-3,5-dimethyl-1-[2-nitro-4-(trifluoromethyl)phenyl]pyrazole Traditional Name: 4-bromo-3,5-dimethyl-1-[2-nitro-4-(trifluoromethyl)phenyl]pyrazole Formula: C12H9BrF3N3O2 MolecularWeight: 364.11797

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C)Br

Isomeric SMILES

CC1=C(C(=NN1C2=C(C=C(C=C2)C(F)(F)F)[N+](=O)[O-])C)Br

InChI

InChI=1S/C12H9BrF3N3O2/c1-6-11(13)7(2)18(17-6)9-4-3-8(12(14,15)16)5-10(9)19(20)21/h3-5H,1-2H3