2-(2,5-dimethylthiophen-3-yl)-8-(trifluoromethyl)quinoline-4-carboxylic acid

Systemtic Name: 2-(2,5-dimethylthiophen-3-yl)-8-(trifluoromethyl)quinoline-4-carboxylic acid Openeye Name: 2-(2,5-dimethyl-3-thienyl)-8-(trifluoromethyl)quinoline-4-carboxylic acid CAS Name: 2-(2,5-dimethyl-3-thiophenyl)-8-(trifluoromethyl)-4-quinolinecarboxylic acid IUPAC Name: 2-(2,5-dimethylthiophen-3-yl)-8-(trifluoromethyl)quinoline-4-carboxylic acid Traditional Name: 2-(2,5-dimethyl-3-thienyl)-8-(trifluoromethyl)cinchoninic acid Formula: C17H12F3NO2S MolecularWeight: 351.34289

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)C2=NC3=C(C=CC=C3C(F)(F)F)C(=C2)C(=O)O

Isomeric SMILES

CC1=CC(=C(S1)C)C2=NC3=C(C=CC=C3C(F)(F)F)C(=C2)C(=O)O

InChI

InChI=1S/C17H12F3NO2S/c1-8-6-11(9(2)24-8)14-7-12(16(22)23)10-4-3-5-13(15(10)21-14)17(18,19)20/h3-7H,1-2H3,(H,22,23)