1-[2-[3-(trifluoromethyl)phenoxy]ethyl]-1,2,3-triazole-4-carboxylate

Systemtic Name: 1-[2-[3-(trifluoromethyl)phenoxy]ethyl]-1,2,3-triazole-4-carboxylate Openeye Name: 1-[2-[3-(trifluoromethyl)phenoxy]ethyl]triazole-4-carboxylate CAS Name: 1-[2-[3-(trifluoromethyl)phenoxy]ethyl]-4-triazolecarboxylate IUPAC Name: 1-[2-[3-(trifluoromethyl)phenoxy]ethyl]triazole-4-carboxylate Traditional Name: 1-[2-[3-(trifluoromethyl)phenoxy]ethyl]triazole-4-carboxylate Formula: C12H9F3N3O3- MolecularWeight: 300.21337

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)OCCN2C=C(N=N2)C(=O)[O-])C(F)(F)F

Isomeric SMILES

C1=CC(=CC(=C1)OCCN2C=C(N=N2)C(=O)[O-])C(F)(F)F

InChI

InChI=1S/C12H10F3N3O3/c13-12(14,15)8-2-1-3-9(6-8)21-5-4-18-7-10(11(19)20)16-17-18/h1-3,6-7H,4-5H2,(H,19,20)/p-1