1-(4-nitrophenyl)-N-(phenylmethyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: 1-(4-nitrophenyl)-N-(phenylmethyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-benzyl-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: 1-(4-nitrophenyl)-N-(phenylmethyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-benzyl-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-benzyl-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C18H13F3N4O3 MolecularWeight: 390.31603

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)C2=C(N(N=C2)C3=CC=C(C=C3)[N+](=O)[O-])C(F)(F)F

InChI

InChI=1S/C18H13F3N4O3/c19-18(20,21)16-15(17(26)22-10-12-4-2-1-3-5-12)11-23-24(16)13-6-8-14(9-7-13)25(27)28/h1-9,11H,10H2,(H,22,26)