4-nitro-1-[2,2,3,3-tetrakis(fluoranyl)propyl]pyrazole-3-carboxylic acid

Systemtic Name: 4-nitro-1-[2,2,3,3-tetrakis(fluoranyl)propyl]pyrazole-3-carboxylic acid Openeye Name: 4-nitro-1-(2,2,3,3-tetrafluoropropyl)pyrazole-3-carboxylic acid CAS Name: 4-nitro-1-(2,2,3,3-tetrafluoropropyl)-3-pyrazolecarboxylic acid IUPAC Name: 4-nitro-1-(2,2,3,3-tetrafluoropropyl)pyrazole-3-carboxylic acid Traditional Name: 4-nitro-1-(2,2,3,3-tetrafluoropropyl)pyrazole-3-carboxylic acid Formula: C7H5F4N3O4 MolecularWeight: 271.125913

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NN1CC(C(F)F)(F)F)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1=C(C(=NN1CC(C(F)F)(F)F)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C7H5F4N3O4/c8-6(9)7(10,11)2-13-1-3(14(17)18)4(12-13)5(15)16/h1,6H,2H2,(H,15,16)