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

Systemtic Name: 3-nitro-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide Openeye Name: 3-nitro-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide CAS Name: 3-nitro-N-[1-[[3-(trifluoromethyl)phenyl]methyl]-4-pyrazolyl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-nitro-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide Traditional Name: 3-nitro-N-[1-[3-(trifluoromethyl)benzyl]pyrazol-4-yl]-1H-pyrazole-5-carboxamide Formula: C15H11F3N6O3 MolecularWeight: 380.28145

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)CN2C=C(C=N2)NC(=O)C3=CC(=NN3)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)CN2C=C(C=N2)NC(=O)C3=CC(=NN3)[N+](=O)[O-]

InChI

InChI=1S/C15H11F3N6O3/c16-15(17,18)10-3-1-2-9(4-10)7-23-8-11(6-19-23)20-14(25)12-5-13(22-21-12)24(26)27/h1-6,8H,7H2,(H,20,25)(H,21,22)