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

Systemtic Name: 1-[5-[bis(fluoranyl)methyl]-3-methyl-5-oxidanyl-4H-pyrazol-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Openeye Name: 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one CAS Name: 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-methyl-3-(4-nitro-1-pyrazolyl)-1-propanone IUPAC Name: 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-4H-pyrazol-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Traditional Name: 1-[5-(difluoromethyl)-5-hydroxy-3-methyl-2-pyrazolin-1-yl]-2-methyl-3-(4-nitropyrazol-1-yl)propan-1-one Formula: C12H15F2N5O4 MolecularWeight: 331.275406

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H15F2N5O4/c1-7(5-17-6-9(4-15-17)19(22)23)10(20)18-12(21,11(13)14)3-8(2)16-18/h4,6-7,11,21H,3,5H2,1-2H3