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

Systemtic Name: 5-phenyl-1-[7-(trifluoromethyl)quinolin-4-yl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-phenyl-1-[7-(trifluoromethyl)-4-quinolyl]triazole-4-carboxylic acid CAS Name: 5-phenyl-1-[7-(trifluoromethyl)-4-quinolinyl]-4-triazolecarboxylic acid IUPAC Name: 5-phenyl-1-[7-(trifluoromethyl)quinolin-4-yl]triazole-4-carboxylic acid Traditional Name: 5-phenyl-1-[7-(trifluoromethyl)-4-quinolyl]triazole-4-carboxylic acid Formula: C19H11F3N4O2 MolecularWeight: 384.31145

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C(N=NN2C3=C4C=CC(=CC4=NC=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C2=C(N=NN2C3=C4C=CC(=CC4=NC=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C19H11F3N4O2/c20-19(21,22)12-6-7-13-14(10-12)23-9-8-15(13)26-17(11-4-2-1-3-5-11)16(18(27)28)24-25-26/h1-10H,(H,27,28)