2-(2-methylpropyl)-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid

Systemtic Name: 2-(2-methylpropyl)-4-oxidanylidene-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Openeye Name: 2-isobutyl-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid CAS Name: 2-(2-methylpropyl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid IUPAC Name: 2-(2-methylpropyl)-4-oxo-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Traditional Name: 2-isobutyl-4-keto-8-(trifluoromethyl)-1H-quinoline-3-carboxylic acid Formula: C15H14F3NO3 MolecularWeight: 313.27177

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C(=O)C2=C(N1)C(=CC=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)CC1=C(C(=O)C2=C(N1)C(=CC=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C15H14F3NO3/c1-7(2)6-10-11(14(21)22)13(20)8-4-3-5-9(12(8)19-10)15(16,17)18/h3-5,7H,6H2,1-2H3,(H,19,20)(H,21,22)