4-acetamido-7-(trifluoromethyl)quinoline-2-carboxylic acid

Systemtic Name: 4-acetamido-7-(trifluoromethyl)quinoline-2-carboxylic acid Openeye Name: 4-acetamido-7-(trifluoromethyl)quinoline-2-carboxylic acid CAS Name: 4-acetamido-7-(trifluoromethyl)-2-quinolinecarboxylic acid IUPAC Name: 4-acetamido-7-(trifluoromethyl)quinoline-2-carboxylic acid Traditional Name: 4-acetamido-7-(trifluoromethyl)quinaldic acid Formula: C13H9F3N2O3 MolecularWeight: 298.21737

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=NC2=C1C=CC(=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=NC2=C1C=CC(=C2)C(F)(F)F)C(=O)O

InChI

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