N-(furan-2-ylmethyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide

Systemtic Name: N-(furan-2-ylmethyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Openeye Name: N-(2-furylmethyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide CAS Name: N-(2-furanylmethyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)-4-pyrazolecarboxamide IUPAC Name: N-(furan-2-ylmethyl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Traditional Name: N-(2-furfuryl)-1-(4-nitrophenyl)-5-(trifluoromethyl)pyrazole-4-carboxamide Formula: C16H11F3N4O4 MolecularWeight: 380.27815

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H11F3N4O4/c17-16(18,19)14-13(15(24)20-8-12-2-1-7-27-12)9-21-22(14)10-3-5-11(6-4-10)23(25)26/h1-7,9H,8H2,(H,20,24)