5-phenethyl-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole

Systemtic Name: 5-phenethyl-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole Openeye Name: 5-phenethyl-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole CAS Name: 5-phenethyl-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole IUPAC Name: 5-phenethyl-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole Traditional Name: 5-phenethyl-3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazole Formula: C17H13F3N2O MolecularWeight: 318.29313

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NC(=NO2)C3=CC=C(C=C3)C(F)(F)F

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NC(=NO2)C3=CC=C(C=C3)C(F)(F)F

InChI

InChI=1S/C17H13F3N2O/c18-17(19,20)14-9-7-13(8-10-14)16-21-15(23-22-16)11-6-12-4-2-1-3-5-12/h1-5,7-10H,6,11H2