5-(4-chloranyl-3-octoxy-phenyl)-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole

Systemtic Name: 5-(4-chloranyl-3-octoxy-phenyl)-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole Openeye Name: 5-(4-chloro-3-octoxy-phenyl)-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole CAS Name: 5-(4-chloro-3-octoxyphenyl)-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole IUPAC Name: 5-(4-chloro-3-octoxyphenyl)-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole Traditional Name: 5-(4-chloro-3-octoxy-phenyl)-3-(2-chlorophenyl)-1-methyl-1,2,4-triazole Formula: C23H27Cl2N3O MolecularWeight: 432.38598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=C(C=CC(=C1)C2=NC(=NN2C)C3=CC=CC=C3Cl)Cl

Isomeric SMILES

CCCCCCCCOC1=C(C=CC(=C1)C2=NC(=NN2C)C3=CC=CC=C3Cl)Cl

InChI

InChI=1S/C23H27Cl2N3O/c1-3-4-5-6-7-10-15-29-21-16-17(13-14-20(21)25)23-26-22(27-28(23)2)18-11-8-9-12-19(18)24/h8-9,11-14,16H,3-7,10,15H2,1-2H3