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

Systemtic Name: 1-methyl-4-nitro-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]pyrazole-3-carboxamide Openeye Name: 1-methyl-4-nitro-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]pyrazole-3-carboxamide CAS Name: 1-methyl-4-nitro-N-[1-[[3-(trifluoromethyl)phenyl]methyl]-4-pyrazolyl]-3-pyrazolecarboxamide IUPAC Name: 1-methyl-4-nitro-N-[1-[[3-(trifluoromethyl)phenyl]methyl]pyrazol-4-yl]pyrazole-3-carboxamide Traditional Name: 1-methyl-4-nitro-N-[1-[3-(trifluoromethyl)benzyl]pyrazol-4-yl]pyrazole-3-carboxamide Formula: C16H13F3N6O3 MolecularWeight: 394.30803

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C(=N1)C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)C(F)(F)F)[N+](=O)[O-]

InChI

InChI=1S/C16H13F3N6O3/c1-23-9-13(25(27)28)14(22-23)15(26)21-12-6-20-24(8-12)7-10-3-2-4-11(5-10)16(17,18)19/h2-6,8-9H,7H2,1H3,(H,21,26)