[2,6-bis(chloranyl)-4-(trifluoromethyloxy)phenoxy]-ethyl-imidazol-1-ylcarbonyl-propyl-azanium

Systemtic Name: [2,6-bis(chloranyl)-4-(trifluoromethyloxy)phenoxy]-ethyl-imidazol-1-ylcarbonyl-propyl-azanium Openeye Name: [2,6-dichloro-4-(trifluoromethoxy)phenoxy]-ethyl-(imidazole-1-carbonyl)-propyl-ammonium CAS Name: [2,6-dichloro-4-(trifluoromethoxy)phenoxy]-ethyl-[1-imidazolyl(oxo)methyl]-propylammonium IUPAC Name: [2,6-dichloro-4-(trifluoromethoxy)phenoxy]-ethyl-(imidazole-1-carbonyl)-propylazanium Traditional Name: [2,6-dichloro-4-(trifluoromethoxy)phenoxy]-ethyl-(imidazole-1-carbonyl)-propyl-ammonium Formula: C16H17Cl2F3N3O3+ MolecularWeight: 427.22569

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC[N+](CC)(C(=O)N1C=CN=C1)OC2=C(C=C(C=C2Cl)OC(F)(F)F)Cl

Isomeric SMILES

CCC[N+](CC)(C(=O)N1C=CN=C1)OC2=C(C=C(C=C2Cl)OC(F)(F)F)Cl

InChI

InChI=1S/C16H17Cl2F3N3O3/c1-3-7-24(4-2,15(25)23-6-5-22-10-23)27-14-12(17)8-11(9-13(14)18)26-16(19,20)21/h5-6,8-10H,3-4,7H2,1-2H3/q+1