2-(3-methylphenyl)-6-(trifluoromethyloxy)quinoline-4-carboxylic acid

Systemtic Name: 2-(3-methylphenyl)-6-(trifluoromethyloxy)quinoline-4-carboxylic acid Openeye Name: 2-(m-tolyl)-6-(trifluoromethoxy)quinoline-4-carboxylic acid CAS Name: 2-(3-methylphenyl)-6-(trifluoromethoxy)-4-quinolinecarboxylic acid IUPAC Name: 2-(3-methylphenyl)-6-(trifluoromethoxy)quinoline-4-carboxylic acid Traditional Name: 2-(m-tolyl)-6-(trifluoromethoxy)cinchoninic acid Formula: C18H12F3NO3 MolecularWeight: 347.28799

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)OC(F)(F)F)C(=C2)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C2=NC3=C(C=C(C=C3)OC(F)(F)F)C(=C2)C(=O)O

InChI

InChI=1S/C18H12F3NO3/c1-10-3-2-4-11(7-10)16-9-14(17(23)24)13-8-12(25-18(19,20)21)5-6-15(13)22-16/h2-9H,1H3,(H,23,24)