6-chloranyl-1-ethyl-4-oxidanylidene-7-(trifluoromethyl)quinoline-3-carboxylic acid

Systemtic Name: 6-chloranyl-1-ethyl-4-oxidanylidene-7-(trifluoromethyl)quinoline-3-carboxylic acid Openeye Name: 6-chloro-1-ethyl-4-oxo-7-(trifluoromethyl)quinoline-3-carboxylic acid CAS Name: 6-chloro-1-ethyl-4-oxo-7-(trifluoromethyl)-3-quinolinecarboxylic acid IUPAC Name: 6-chloro-1-ethyl-4-oxo-7-(trifluoromethyl)quinoline-3-carboxylic acid Traditional Name: 6-chloro-1-ethyl-4-keto-7-(trifluoromethyl)quinoline-3-carboxylic acid Formula: C13H9ClF3NO3 MolecularWeight: 319.66367

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C(=O)C2=CC(=C(C=C21)C(F)(F)F)Cl)C(=O)O

Isomeric SMILES

CCN1C=C(C(=O)C2=CC(=C(C=C21)C(F)(F)F)Cl)C(=O)O

InChI

InChI=1S/C13H9ClF3NO3/c1-2-18-5-7(12(20)21)11(19)6-3-9(14)8(4-10(6)18)13(15,16)17/h3-5H,2H2,1H3,(H,20,21)