2-(4-nitrophenyl)-1-[5-oxidanyl-3-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone

Systemtic Name: 2-(4-nitrophenyl)-1-[5-oxidanyl-3-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Openeye Name: 1-[5-hydroxy-3-(4-pyridyl)-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitrophenyl)ethanone CAS Name: 1-[5-hydroxy-3-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitrophenyl)ethanone IUPAC Name: 1-[5-hydroxy-3-pyridin-4-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitrophenyl)ethanone Traditional Name: 1-[5-hydroxy-3-(4-pyridyl)-5-(trifluoromethyl)-2-pyrazolin-1-yl]-2-(4-nitrophenyl)ethanone Formula: C17H13F3N4O4 MolecularWeight: 394.30473

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=NN(C1(C(F)(F)F)O)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=NC=C3

Isomeric SMILES

C1C(=NN(C1(C(F)(F)F)O)C(=O)CC2=CC=C(C=C2)[N+](=O)[O-])C3=CC=NC=C3

InChI

InChI=1S/C17H13F3N4O4/c18-17(19,20)16(26)10-14(12-5-7-21-8-6-12)22-23(16)15(25)9-11-1-3-13(4-2-11)24(27)28/h1-8,26H,9-10H2