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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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