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

Systemtic Name: 5-cyclopropyl-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylic acid Openeye Name: 5-cyclopropyl-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylic acid CAS Name: 5-cyclopropyl-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylic acid IUPAC Name: 5-cyclopropyl-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylic acid Traditional Name: 5-cyclopropyl-1-[4-(trifluoromethyl)phenyl]-1,2,4-triazole-3-carboxylic acid Formula: C13H10F3N3O2 MolecularWeight: 297.23261

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C2=NC(=NN2C3=CC=C(C=C3)C(F)(F)F)C(=O)O

Isomeric SMILES

C1CC1C2=NC(=NN2C3=CC=C(C=C3)C(F)(F)F)C(=O)O

InChI

InChI=1S/C13H10F3N3O2/c14-13(15,16)8-3-5-9(6-4-8)19-11(7-1-2-7)17-10(18-19)12(20)21/h3-7H,1-2H2,(H,20,21)