5-nitro-2-(phenylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide

Systemtic Name: 5-nitro-2-(phenylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide Openeye Name: 2-benzyl-5-nitro-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide CAS Name: 5-nitro-2-(phenylmethyl)-N-[[3-(trifluoromethyl)phenyl]methyl]-3-pyrazolecarboxamide IUPAC Name: 2-benzyl-5-nitro-N-[[3-(trifluoromethyl)phenyl]methyl]pyrazole-3-carboxamide Traditional Name: 2-benzyl-5-nitro-N-[3-(trifluoromethyl)benzyl]pyrazole-3-carboxamide Formula: C19H15F3N4O3 MolecularWeight: 404.34261

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C(=CC(=N2)[N+](=O)[O-])C(=O)NCC3=CC(=CC=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CN2C(=CC(=N2)[N+](=O)[O-])C(=O)NCC3=CC(=CC=C3)C(F)(F)F

InChI

InChI=1S/C19H15F3N4O3/c20-19(21,22)15-8-4-7-14(9-15)11-23-18(27)16-10-17(26(28)29)24-25(16)12-13-5-2-1-3-6-13/h1-10H,11-12H2,(H,23,27)