5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxylic acid

Systemtic Name: 5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxylic acid Openeye Name: 5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxylic acid CAS Name: 5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxylic acid IUPAC Name: 5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxylic acid Traditional Name: 5-[2-(trifluoromethyl)phenyl]-1H-pyrrole-2-carboxylic acid Formula: C12H8F3NO2 MolecularWeight: 255.19263

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C2=CC=C(N2)C(=O)O)C(F)(F)F

Isomeric SMILES

C1=CC=C(C(=C1)C2=CC=C(N2)C(=O)O)C(F)(F)F

InChI

InChI=1S/C12H8F3NO2/c13-12(14,15)8-4-2-1-3-7(8)9-5-6-10(16-9)11(17)18/h1-6,16H,(H,17,18)