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

Systemtic Name: 5-propan-2-yl-1-[2-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxylic acid Openeye Name: 5-isopropyl-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxylic acid CAS Name: 5-propan-2-yl-1-[2-(trifluoromethyl)phenyl]-4-triazolecarboxylic acid IUPAC Name: 5-propan-2-yl-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxylic acid Traditional Name: 5-isopropyl-1-[2-(trifluoromethyl)phenyl]triazole-4-carboxylic acid Formula: C13H12F3N3O2 MolecularWeight: 299.24849

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N=NN1C2=CC=CC=C2C(F)(F)F)C(=O)O

Isomeric SMILES

CC(C)C1=C(N=NN1C2=CC=CC=C2C(F)(F)F)C(=O)O

InChI

InChI=1S/C13H12F3N3O2/c1-7(2)11-10(12(20)21)17-18-19(11)9-6-4-3-5-8(9)13(14,15)16/h3-7H,1-2H3,(H,20,21)