3-[4-bromanyl-3-(trifluoromethyl)pyrazol-1-yl]propanoic acid

Systemtic Name: 3-[4-bromanyl-3-(trifluoromethyl)pyrazol-1-yl]propanoic acid Openeye Name: 3-[4-bromo-3-(trifluoromethyl)pyrazol-1-yl]propanoic acid CAS Name: 3-[4-bromo-3-(trifluoromethyl)-1-pyrazolyl]propanoic acid IUPAC Name: 3-[4-bromo-3-(trifluoromethyl)pyrazol-1-yl]propanoic acid Traditional Name: 3-[4-bromo-3-(trifluoromethyl)pyrazol-1-yl]propionic acid Formula: C7H6BrF3N2O2 MolecularWeight: 287.03395

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C(=NN1CCC(=O)O)C(F)(F)F)Br

Isomeric SMILES

C1=C(C(=NN1CCC(=O)O)C(F)(F)F)Br

InChI

InChI=1S/C7H6BrF3N2O2/c8-4-3-13(2-1-5(14)15)12-6(4)7(9,10)11/h3H,1-2H2,(H,14,15)