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

Systemtic Name: 1-[5-cyclopropyl-3-oxidanyl-3-(trifluoromethyl)-1H-pyrazol-2-yl]-2-(4-nitrophenyl)ethanone Openeye Name: 1-[5-cyclopropyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]-2-(4-nitrophenyl)ethanone CAS Name: 1-[5-cyclopropyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]-2-(4-nitrophenyl)ethanone IUPAC Name: 1-[5-cyclopropyl-3-hydroxy-3-(trifluoromethyl)-1H-pyrazol-2-yl]-2-(4-nitrophenyl)ethanone Traditional Name: 1-[3-cyclopropyl-5-hydroxy-5-(trifluoromethyl)-3-pyrazolin-1-yl]-2-(4-nitrophenyl)ethanone Formula: C15H14F3N3O4 MolecularWeight: 357.28457

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=CC(N(N2)C(=O)CC3=CC=C(C=C3)[N+](=O)[O-])(C(F)(F)F)O

Isomeric SMILES

C1CC1C2=CC(N(N2)C(=O)CC3=CC=C(C=C3)[N+](=O)[O-])(C(F)(F)F)O

InChI

InChI=1S/C15H14F3N3O4/c16-15(17,18)14(23)8-12(10-3-4-10)19-20(14)13(22)7-9-1-5-11(6-2-9)21(24)25/h1-2,5-6,8,10,19,23H,3-4,7H2