5-methyl-1-[7-(trifluoromethyl)quinolin-4-yl]-1,2,3-triazole-4-carboxylic acid

Systemtic Name: 5-methyl-1-[7-(trifluoromethyl)quinolin-4-yl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-methyl-1-[7-(trifluoromethyl)-4-quinolyl]triazole-4-carboxylic acid CAS Name: 5-methyl-1-[7-(trifluoromethyl)-4-quinolinyl]-4-triazolecarboxylic acid IUPAC Name: 5-methyl-1-[7-(trifluoromethyl)quinolin-4-yl]triazole-4-carboxylic acid Traditional Name: 5-methyl-1-[7-(trifluoromethyl)-4-quinolyl]triazole-4-carboxylic acid Formula: C14H9F3N4O2 MolecularWeight: 322.24207

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=NN1C2=C3C=CC(=CC3=NC=C2)C(F)(F)F)C(=O)O

Isomeric SMILES

CC1=C(N=NN1C2=C3C=CC(=CC3=NC=C2)C(F)(F)F)C(=O)O

InChI

InChI=1S/C14H9F3N4O2/c1-7-12(13(22)23)19-20-21(7)11-4-5-18-10-6-8(14(15,16)17)2-3-9(10)11/h2-6H,1H3,(H,22,23)