2-bromanyl-6-methyl-4-(trifluoromethyl)quinoline-3-carboxylic acid

Systemtic Name: 2-bromanyl-6-methyl-4-(trifluoromethyl)quinoline-3-carboxylic acid Openeye Name: 2-bromo-6-methyl-4-(trifluoromethyl)quinoline-3-carboxylic acid CAS Name: 2-bromo-6-methyl-4-(trifluoromethyl)-3-quinolinecarboxylic acid IUPAC Name: 2-bromo-6-methyl-4-(trifluoromethyl)quinoline-3-carboxylic acid Traditional Name: 2-bromo-6-methyl-4-(trifluoromethyl)quinoline-3-carboxylic acid Formula: C12H7BrF3NO2 MolecularWeight: 334.08869

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=C(N=C2C=C1)Br)C(=O)O)C(F)(F)F

Isomeric SMILES

CC1=CC2=C(C(=C(N=C2C=C1)Br)C(=O)O)C(F)(F)F

InChI

InChI=1S/C12H7BrF3NO2/c1-5-2-3-7-6(4-5)9(12(14,15)16)8(11(18)19)10(13)17-7/h2-4H,1H3,(H,18,19)