6-bromanyl-8-(trifluoromethyl)quinoline-2-carboxylic acid

Systemtic Name: 6-bromanyl-8-(trifluoromethyl)quinoline-2-carboxylic acid Openeye Name: 6-bromo-8-(trifluoromethyl)quinoline-2-carboxylic acid CAS Name: 6-bromo-8-(trifluoromethyl)-2-quinolinecarboxylic acid IUPAC Name: 6-bromo-8-(trifluoromethyl)quinoline-2-carboxylic acid Traditional Name: 6-bromo-8-(trifluoromethyl)quinaldic acid Formula: C11H5BrF3NO2 MolecularWeight: 320.06211

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=NC2=C(C=C(C=C21)Br)C(F)(F)F)C(=O)O

Isomeric SMILES

C1=CC(=NC2=C(C=C(C=C21)Br)C(F)(F)F)C(=O)O

InChI

InChI=1S/C11H5BrF3NO2/c12-6-3-5-1-2-8(10(17)18)16-9(5)7(4-6)11(13,14)15/h1-4H,(H,17,18)