N-[3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-4-nitro-benzamide

Systemtic Name: N-[3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-4-nitro-benzamide Openeye Name: N-[3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-4-nitro-benzamide CAS Name: N-[3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]-4-pyrazolyl]-4-nitrobenzamide IUPAC Name: N-[3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-4-nitrobenzamide Traditional Name: N-[3,5-dimethyl-1-[3-(trifluoromethyl)benzyl]pyrazol-4-yl]-4-nitro-benzamide Formula: C20H17F3N4O3 MolecularWeight: 418.36919

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC(=CC=C2)C(F)(F)F)C)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)C(F)(F)F)C)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17F3N4O3/c1-12-18(24-19(28)15-6-8-17(9-7-15)27(29)30)13(2)26(25-12)11-14-4-3-5-16(10-14)20(21,22)23/h3-10H,11H2,1-2H3,(H,24,28)