2-[2,2-bis(fluoranyl)ethyl]-5-methoxy-4-nitro-pyrazole-3-carboxylic acid

Systemtic Name: 2-[2,2-bis(fluoranyl)ethyl]-5-methoxy-4-nitro-pyrazole-3-carboxylic acid Openeye Name: 2-(2,2-difluoroethyl)-5-methoxy-4-nitro-pyrazole-3-carboxylic acid CAS Name: 2-(2,2-difluoroethyl)-5-methoxy-4-nitro-3-pyrazolecarboxylic acid IUPAC Name: 2-(2,2-difluoroethyl)-5-methoxy-4-nitropyrazole-3-carboxylic acid Traditional Name: 2-(2,2-difluoroethyl)-5-methoxy-4-nitro-pyrazole-3-carboxylic acid Formula: C7H7F2N3O5 MolecularWeight: 251.144386

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NN(C(=C1[N+](=O)[O-])C(=O)O)CC(F)F

Isomeric SMILES

COC1=NN(C(=C1[N+](=O)[O-])C(=O)O)CC(F)F

InChI

InChI=1S/C7H7F2N3O5/c1-17-6-4(12(15)16)5(7(13)14)11(10-6)2-3(8)9/h3H,2H2,1H3,(H,13,14)