2-(4-propan-2-ylphenyl)-6-(trifluoromethyl)quinoline-4-carboxylic acid

Systemtic Name: 2-(4-propan-2-ylphenyl)-6-(trifluoromethyl)quinoline-4-carboxylic acid Openeye Name: 2-(4-isopropylphenyl)-6-(trifluoromethyl)quinoline-4-carboxylic acid CAS Name: 2-(4-propan-2-ylphenyl)-6-(trifluoromethyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(4-propan-2-ylphenyl)-6-(trifluoromethyl)quinoline-4-carboxylic acid Traditional Name: 2-p-cumenyl-6-(trifluoromethyl)cinchoninic acid Formula: C20H16F3NO2 MolecularWeight: 359.34175

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(F)(F)F)C(=C2)C(=O)O

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)C(F)(F)F)C(=C2)C(=O)O

InChI

InChI=1S/C20H16F3NO2/c1-11(2)12-3-5-13(6-4-12)18-10-16(19(25)26)15-9-14(20(21,22)23)7-8-17(15)24-18/h3-11H,1-2H3,(H,25,26)