2-methyl-1-[3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-3-(4-nitropyrazol-1-yl)propan-1-one

Systemtic Name: 2-methyl-1-[3-methyl-5-oxidanyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-3-(4-nitropyrazol-1-yl)propan-1-one Openeye Name: 1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one CAS Name: 1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methyl-3-(4-nitro-1-pyrazolyl)-1-propanone IUPAC Name: 1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-4H-pyrazol-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Traditional Name: 1-[5-hydroxy-3-methyl-5-(trifluoromethyl)-2-pyrazolin-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Formula: C12H14F3N5O4 MolecularWeight: 349.26587

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C(C)CN2C=C(C=N2)[N+](=O)[O-]

Isomeric SMILES

CC1=NN(C(C1)(C(F)(F)F)O)C(=O)C(C)CN2C=C(C=N2)[N+](=O)[O-]

InChI

InChI=1S/C12H14F3N5O4/c1-7(5-18-6-9(4-16-18)20(23)24)10(21)19-11(22,12(13,14)15)3-8(2)17-19/h4,6-7,22H,3,5H2,1-2H3