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

Systemtic Name: 2-(4-nitrophenoxy)-1-[5-oxidanyl-3-propan-2-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Openeye Name: 1-[5-hydroxy-3-isopropyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitrophenoxy)ethanone CAS Name: 1-[5-hydroxy-3-propan-2-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitrophenoxy)ethanone IUPAC Name: 1-[5-hydroxy-3-propan-2-yl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitrophenoxy)ethanone Traditional Name: 1-[5-hydroxy-3-isopropyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]-2-(4-nitrophenoxy)ethanone Formula: C15H16F3N3O5 MolecularWeight: 375.29985

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C(C1)(C(F)(F)F)O)C(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=NN(C(C1)(C(F)(F)F)O)C(=O)COC2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C15H16F3N3O5/c1-9(2)12-7-14(23,15(16,17)18)20(19-12)13(22)8-26-11-5-3-10(4-6-11)21(24)25/h3-6,9,23H,7-8H2,1-2H3