4-bromanyl-2-ethyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide

Systemtic Name: 4-bromanyl-2-ethyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide Openeye Name: 4-bromo-2-ethyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide CAS Name: 4-bromo-2-ethyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]-3-pyrazolecarboxamide IUPAC Name: 4-bromo-2-ethyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide Traditional Name: 4-bromo-2-ethyl-N-[3-nitro-5-[3-(trifluoromethyl)phenoxy]phenyl]pyrazole-3-carboxamide Formula: C19H14BrF3N4O4 MolecularWeight: 499.23807

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C=N1)Br)C(=O)NC2=CC(=CC(=C2)OC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CCN1C(=C(C=N1)Br)C(=O)NC2=CC(=CC(=C2)OC3=CC=CC(=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C19H14BrF3N4O4/c1-2-26-17(16(20)10-24-26)18(28)25-12-7-13(27(29)30)9-15(8-12)31-14-5-3-4-11(6-14)19(21,22)23/h3-10H,2H2,1H3,(H,25,28)