1-(1-chloranylpropan-2-yl)-6,7,8-tris(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid

Systemtic Name: 1-(1-chloranylpropan-2-yl)-6,7,8-tris(fluoranyl)-4-oxidanylidene-quinoline-3-carboxylic acid Openeye Name: 1-(2-chloro-1-methyl-ethyl)-6,7,8-trifluoro-4-oxo-quinoline-3-carboxylic acid CAS Name: 1-(1-chloropropan-2-yl)-6,7,8-trifluoro-4-oxo-3-quinolinecarboxylic acid IUPAC Name: 1-(1-chloropropan-2-yl)-6,7,8-trifluoro-4-oxoquinoline-3-carboxylic acid Traditional Name: 1-(2-chloro-1-methyl-ethyl)-6,7,8-trifluoro-4-keto-quinoline-3-carboxylic acid Formula: C13H9ClF3NO3 MolecularWeight: 319.66367

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCl)N1C=C(C(=O)C2=CC(=C(C(=C21)F)F)F)C(=O)O

Isomeric SMILES

CC(CCl)N1C=C(C(=O)C2=CC(=C(C(=C21)F)F)F)C(=O)O

InChI

InChI=1S/C13H9ClF3NO3/c1-5(3-14)18-4-7(13(20)21)12(19)6-2-8(15)9(16)10(17)11(6)18/h2,4-5H,3H2,1H3,(H,20,21)