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

Systemtic Name: N-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethyl]-4-nitro-3-oxidanyl-benzamide Openeye Name: 3-hydroxy-N-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethyl]-4-nitro-benzamide CAS Name: 3-hydroxy-N-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]-4-pyrazolyl]ethyl]-4-nitrobenzamide IUPAC Name: 3-hydroxy-N-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethyl]-4-nitrobenzamide Traditional Name: 3-hydroxy-N-[1-[5-methyl-1-[3-(trifluoromethyl)phenyl]pyrazol-4-yl]ethyl]-4-nitro-benzamide Formula: C20H17F3N4O4 MolecularWeight: 434.36859

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(C)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])O

Isomeric SMILES

CC1=C(C=NN1C2=CC=CC(=C2)C(F)(F)F)C(C)NC(=O)C3=CC(=C(C=C3)[N+](=O)[O-])O

InChI

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