5-[1-(4-chloranyl-2-methyl-phenoxy)ethyl]-3-(2-methylphenyl)-1H-1,2,4-triazole

Systemtic Name: 5-[1-(4-chloranyl-2-methyl-phenoxy)ethyl]-3-(2-methylphenyl)-1H-1,2,4-triazole Openeye Name: 5-[1-(4-chloro-2-methyl-phenoxy)ethyl]-3-(o-tolyl)-1H-1,2,4-triazole CAS Name: 5-[1-(4-chloro-2-methylphenoxy)ethyl]-3-(2-methylphenyl)-1H-1,2,4-triazole IUPAC Name: 5-[1-(4-chloro-2-methylphenoxy)ethyl]-3-(2-methylphenyl)-1H-1,2,4-triazole Traditional Name: 5-[1-(4-chloro-2-methyl-phenoxy)ethyl]-3-(o-tolyl)-1H-1,2,4-triazole Formula: C18H18ClN3O MolecularWeight: 327.80802

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C2=NNC(=N2)C(C)OC3=C(C=C(C=C3)Cl)C

Isomeric SMILES

CC1=CC=CC=C1C2=NNC(=N2)C(C)OC3=C(C=C(C=C3)Cl)C

InChI

InChI=1S/C18H18ClN3O/c1-11-6-4-5-7-15(11)18-20-17(21-22-18)13(3)23-16-9-8-14(19)10-12(16)2/h4-10,13H,1-3H3,(H,20,21,22)