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

Systemtic Name: 5-pyridin-4-yl-1-[3-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-(4-pyridyl)-1-[3-(trifluoromethyl)phenyl]triazole-4-carboxylic acid CAS Name: 5-pyridin-4-yl-1-[3-(trifluoromethyl)phenyl]-4-triazolecarboxylic acid IUPAC Name: 5-pyridin-4-yl-1-[3-(trifluoromethyl)phenyl]triazole-4-carboxylic acid Traditional Name: 5-(4-pyridyl)-1-[3-(trifluoromethyl)phenyl]triazole-4-carboxylic acid Formula: C15H9F3N4O2 MolecularWeight: 334.25277

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N2C(=C(N=N2)C(=O)O)C3=CC=NC=C3)C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)N2C(=C(N=N2)C(=O)O)C3=CC=NC=C3)C(F)(F)F

InChI

InChI=1S/C15H9F3N4O2/c16-15(17,18)10-2-1-3-11(8-10)22-13(9-4-6-19-7-5-9)12(14(23)24)20-21-22/h1-8H,(H,23,24)