N-[3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]-4-pyrazolyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[3,5-dimethyl-1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[3,5-dimethyl-1-[3-(trifluoromethyl)benzyl]pyrazol-4-yl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C18H17F3N6O4 MolecularWeight: 438.36059

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=C(C(=NN3)OC)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC(=CC=C2)C(F)(F)F)C)NC(=O)C3=C(C(=NN3)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H17F3N6O4/c1-9-13(22-16(28)14-15(27(29)30)17(31-3)24-23-14)10(2)26(25-9)8-11-5-4-6-12(7-11)18(19,20)21/h4-7H,8H2,1-3H3,(H,22,28)(H,23,24)