2-(4-nitropyrazol-1-yl)-1-[(5S)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone

Systemtic Name: 2-(4-nitropyrazol-1-yl)-1-[(5S)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone Openeye Name: 1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitropyrazol-1-yl)ethanone CAS Name: 1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitro-1-pyrazolyl)ethanone IUPAC Name: 1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(4-nitropyrazol-1-yl)ethanone Traditional Name: 1-[(5S)-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]-2-(4-nitropyrazol-1-yl)ethanone Formula: C9H8F3N5O4 MolecularWeight: 307.18613

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Descriptors Computed from Structure

Canonical SMILES:

C1C=NN(C1(C(F)(F)F)O)C(=O)CN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

C1C=NN([C@]1(C(F)(F)F)O)C(=O)CN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C9H8F3N5O4/c10-9(11,12)8(19)1-2-13-16(8)7(18)5-15-4-6(3-14-15)17(20)21/h2-4,19H,1,5H2/t8-/m0/s1