5-(2-methylprop-1-enyl)-1-[3-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 5-(2-methylprop-1-enyl)-1-[3-(trifluoromethyl)phenyl]-1,2,3-triazole-4-carboxylate Openeye Name: 5-(2-methylprop-1-enyl)-1-[3-(trifluoromethyl)phenyl]triazole-4-carboxylate CAS Name: 5-(2-methylprop-1-enyl)-1-[3-(trifluoromethyl)phenyl]-4-triazolecarboxylate IUPAC Name: 5-(2-methylprop-1-enyl)-1-[3-(trifluoromethyl)phenyl]triazole-4-carboxylate Traditional Name: 5-(2-methylprop-1-enyl)-1-[3-(trifluoromethyl)phenyl]triazole-4-carboxylate Formula: C14H11F3N3O2- MolecularWeight: 310.25125

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CC1=C(N=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)[O-])C

Isomeric SMILES

CC(=CC1=C(N=NN1C2=CC=CC(=C2)C(F)(F)F)C(=O)[O-])C

InChI

InChI=1S/C14H12F3N3O2/c1-8(2)6-11-12(13(21)22)18-19-20(11)10-5-3-4-9(7-10)14(15,16)17/h3-7H,1-2H3,(H,21,22)/p-1