2-[3,5-bis[bis(fluoranyl)methyl]-4-nitro-pyrazol-1-yl]ethanoate

Systemtic Name: 2-[3,5-bis[bis(fluoranyl)methyl]-4-nitro-pyrazol-1-yl]ethanoate Openeye Name: 2-[3,5-bis(difluoromethyl)-4-nitro-pyrazol-1-yl]acetate CAS Name: 2-[3,5-bis(difluoromethyl)-4-nitro-1-pyrazolyl]acetate IUPAC Name: 2-[3,5-bis(difluoromethyl)-4-nitropyrazol-1-yl]acetate Traditional Name: 2-[3,5-bis(difluoromethyl)-4-nitro-pyrazol-1-yl]acetate Formula: C7H4F4N3O4- MolecularWeight: 270.117973

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Descriptors Computed from Structure

Canonical SMILES:

C(C(=O)[O-])N1C(=C(C(=N1)C(F)F)[N+](=O)[O-])C(F)F

Isomeric SMILES

C(C(=O)[O-])N1C(=C(C(=N1)C(F)F)[N+](=O)[O-])C(F)F

InChI

InChI=1S/C7H5F4N3O4/c8-6(9)3-4(14(17)18)5(7(10)11)13(12-3)1-2(15)16/h6-7H,1H2,(H,15,16)/p-1