N-[2-fluoranyl-5-(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[2-fluoranyl-5-(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[2-fluoro-5-(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[2-fluoro-5-(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[2-fluoro-5-(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-[2-fluoro-5-(trifluoromethyl)phenyl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C13H10F4N4O3 MolecularWeight: 346.237113

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)C(F)(F)F)F)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=C(C=CC(=C2)C(F)(F)F)F)C

InChI

InChI=1S/C13H10F4N4O3/c1-6-10(21(23)24)11(20(2)19-6)12(22)18-9-5-7(13(15,16)17)3-4-8(9)14/h3-5H,1-2H3,(H,18,22)