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

Systemtic Name: 3-methyl-1-[2,2,3,3-tetrakis(fluoranyl)propyl]pyrazole-4-carboxylic acid Openeye Name: 3-methyl-1-(2,2,3,3-tetrafluoropropyl)pyrazole-4-carboxylic acid CAS Name: 3-methyl-1-(2,2,3,3-tetrafluoropropyl)-4-pyrazolecarboxylic acid IUPAC Name: 3-methyl-1-(2,2,3,3-tetrafluoropropyl)pyrazole-4-carboxylic acid Traditional Name: 3-methyl-1-(2,2,3,3-tetrafluoropropyl)pyrazole-4-carboxylic acid Formula: C8H8F4N2O2 MolecularWeight: 240.154933

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1C(=O)O)CC(C(F)F)(F)F

Isomeric SMILES

CC1=NN(C=C1C(=O)O)CC(C(F)F)(F)F

InChI

InChI=1S/C8H8F4N2O2/c1-4-5(6(15)16)2-14(13-4)3-8(11,12)7(9)10/h2,7H,3H2,1H3,(H,15,16)