4-bromanyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid

Systemtic Name: 4-bromanyl-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid Openeye Name: 4-bromo-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid CAS Name: 4-bromo-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid IUPAC Name: 4-bromo-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid Traditional Name: 4-bromo-5-(trifluoromethyl)-1H-pyrazole-3-carboxylic acid Formula: C5H2BrF3N2O2 MolecularWeight: 258.98079

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Descriptors Computed from Structure

Canonical SMILES:

C1(=C(NN=C1C(=O)O)C(F)(F)F)Br

Isomeric SMILES

C1(=C(NN=C1C(=O)O)C(F)(F)F)Br

InChI

InChI=1S/C5H2BrF3N2O2/c6-1-2(4(12)13)10-11-3(1)5(7,8)9/h(H,10,11)(H,12,13)