4-acetamido-8-(trifluoromethyl)quinoline-2-carboxylic acid

Systemtic Name: 4-acetamido-8-(trifluoromethyl)quinoline-2-carboxylic acid Openeye Name: 4-acetamido-8-(trifluoromethyl)quinoline-2-carboxylic acid CAS Name: 4-acetamido-8-(trifluoromethyl)-2-quinolinecarboxylic acid IUPAC Name: 4-acetamido-8-(trifluoromethyl)quinoline-2-carboxylic acid Traditional Name: 4-acetamido-8-(trifluoromethyl)quinaldic acid Formula: C13H9F3N2O3 MolecularWeight: 298.21737

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=NC2=C1C=CC=C2C(F)(F)F)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=NC2=C1C=CC=C2C(F)(F)F)C(=O)O

InChI

InChI=1S/C13H9F3N2O3/c1-6(19)17-9-5-10(12(20)21)18-11-7(9)3-2-4-8(11)13(14,15)16/h2-5H,1H3,(H,20,21)(H,17,18,19)