2-(3-methyl-4-nitro-pyrazol-1-yl)-1-[(5S)-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]ethanone

Systemtic Name: 2-(3-methyl-4-nitro-pyrazol-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-(3-methyl-4-nitro-pyrazol-1-yl)ethanone CAS Name: 1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(3-methyl-4-nitro-1-pyrazolyl)ethanone IUPAC Name: 1-[(5S)-5-hydroxy-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-(3-methyl-4-nitropyrazol-1-yl)ethanone Traditional Name: 1-[(5S)-5-hydroxy-5-(trifluoromethyl)-2-pyrazolin-1-yl]-2-(3-methyl-4-nitro-pyrazol-1-yl)ethanone Formula: C10H10F3N5O4 MolecularWeight: 321.21271

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1[N+](=O)[O-])CC(=O)N2C(CC=N2)(C(F)(F)F)O

Isomeric SMILES

CC1=NN(C=C1[N+](=O)[O-])CC(=O)N2[C@](CC=N2)(C(F)(F)F)O

InChI

InChI=1S/C10H10F3N5O4/c1-6-7(18(21)22)4-16(15-6)5-8(19)17-9(20,2-3-14-17)10(11,12)13/h3-4,20H,2,5H2,1H3/t9-/m0/s1