4-acetamido-8-chloranyl-5-(trifluoromethyl)quinoline-2-carboxylic acid

Systemtic Name: 4-acetamido-8-chloranyl-5-(trifluoromethyl)quinoline-2-carboxylic acid Openeye Name: 4-acetamido-8-chloro-5-(trifluoromethyl)quinoline-2-carboxylic acid CAS Name: 4-acetamido-8-chloro-5-(trifluoromethyl)-2-quinolinecarboxylic acid IUPAC Name: 4-acetamido-8-chloro-5-(trifluoromethyl)quinoline-2-carboxylic acid Traditional Name: 4-acetamido-8-chloro-5-(trifluoromethyl)quinaldic acid Formula: C13H8ClF3N2O3 MolecularWeight: 332.66243

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=NC2=C(C=CC(=C12)C(F)(F)F)Cl)C(=O)O

Isomeric SMILES

CC(=O)NC1=CC(=NC2=C(C=CC(=C12)C(F)(F)F)Cl)C(=O)O

InChI

InChI=1S/C13H8ClF3N2O3/c1-5(20)18-8-4-9(12(21)22)19-11-7(14)3-2-6(10(8)11)13(15,16)17/h2-4H,1H3,(H,21,22)(H,18,19,20)