4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(trifluoromethyloxy)phenyl]benzamide

Systemtic Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(trifluoromethyloxy)phenyl]benzamide Openeye Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(trifluoromethoxy)phenyl]benzamide CAS Name: 4-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-N-[2-(trifluoromethoxy)phenyl]benzamide IUPAC Name: 4-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-N-[2-(trifluoromethoxy)phenyl]benzamide Traditional Name: 4-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-N-[2-(trifluoromethoxy)phenyl]benzamide Formula: C20H17F3N4O4 MolecularWeight: 434.36859

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3OC(F)(F)F)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(C=C2)C(=O)NC3=CC=CC=C3OC(F)(F)F)C)[N+](=O)[O-]

InChI

InChI=1S/C20H17F3N4O4/c1-12-18(27(29)30)13(2)26(25-12)11-14-7-9-15(10-8-14)19(28)24-16-5-3-4-6-17(16)31-20(21,22)23/h3-10H,11H2,1-2H3,(H,24,28)