4-(2-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazole

Systemtic Name: 4-(2-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Openeye Name: 4-(2-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazole CAS Name: 4-(2-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazole IUPAC Name: 4-(2-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Traditional Name: 4-(2-tert-butylphenyl)-3-(trifluoromethyl)-1,2,4-triazole Formula: C13H14F3N3 MolecularWeight: 269.26557

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=CC=C1N2C=NN=C2C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=CC=C1N2C=NN=C2C(F)(F)F

InChI

InChI=1S/C13H14F3N3/c1-12(2,3)9-6-4-5-7-10(9)19-8-17-18-11(19)13(14,15)16/h4-8H,1-3H3