3-[3-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylic acid

Systemtic Name: 3-[3-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylic acid Openeye Name: 3-[3-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylic acid CAS Name: 3-[3-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylic acid IUPAC Name: 3-[3-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylic acid Traditional Name: 3-[3-(trifluoromethyl)phenyl]-1H-pyrazole-5-carboxylic acid Formula: C11H7F3N2O2 MolecularWeight: 256.18069

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)C(F)(F)F)C2=NNC(=C2)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)C(F)(F)F)C2=NNC(=C2)C(=O)O

InChI

InChI=1S/C11H7F3N2O2/c12-11(13,14)7-3-1-2-6(4-7)8-5-9(10(17)18)16-15-8/h1-5H,(H,15,16)(H,17,18)