N-(4-fluoranyl-3-nitro-phenyl)-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanamide

Systemtic Name: N-(4-fluoranyl-3-nitro-phenyl)-2-[3-(trifluoromethyl)pyrazol-1-yl]ethanamide Openeye Name: N-(4-fluoro-3-nitro-phenyl)-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide CAS Name: N-(4-fluoro-3-nitrophenyl)-2-[3-(trifluoromethyl)-1-pyrazolyl]acetamide IUPAC Name: N-(4-fluoro-3-nitrophenyl)-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide Traditional Name: N-(4-fluoro-3-nitro-phenyl)-2-[3-(trifluoromethyl)pyrazol-1-yl]acetamide Formula: C12H8F4N4O3 MolecularWeight: 332.210533

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CN2C=CC(=N2)C(F)(F)F)[N+](=O)[O-])F

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CN2C=CC(=N2)C(F)(F)F)[N+](=O)[O-])F

InChI

InChI=1S/C12H8F4N4O3/c13-8-2-1-7(5-9(8)20(22)23)17-11(21)6-19-4-3-10(18-19)12(14,15)16/h1-5H,6H2,(H,17,21)