1-[4-(4-chloranyl-3,5-dimethyl-phenoxy)butyl]-2-[(4-ethylphenoxy)methyl]benzimidazole

Systemtic Name: 1-[4-(4-chloranyl-3,5-dimethyl-phenoxy)butyl]-2-[(4-ethylphenoxy)methyl]benzimidazole Openeye Name: 1-[4-(4-chloro-3,5-dimethyl-phenoxy)butyl]-2-[(4-ethylphenoxy)methyl]benzimidazole CAS Name: 1-[4-(4-chloro-3,5-dimethylphenoxy)butyl]-2-[(4-ethylphenoxy)methyl]benzimidazole IUPAC Name: 1-[4-(4-chloro-3,5-dimethylphenoxy)butyl]-2-[(4-ethylphenoxy)methyl]benzimidazole Traditional Name: 1-[4-(4-chloro-3,5-dimethyl-phenoxy)butyl]-2-[(4-ethylphenoxy)methyl]benzimidazole Formula: C28H31ClN2O2 MolecularWeight: 463.01094

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CCCCOC4=CC(=C(C(=C4)C)Cl)C

Isomeric SMILES

CCC1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CCCCOC4=CC(=C(C(=C4)C)Cl)C

InChI

InChI=1S/C28H31ClN2O2/c1-4-22-11-13-23(14-12-22)33-19-27-30-25-9-5-6-10-26(25)31(27)15-7-8-16-32-24-17-20(2)28(29)21(3)18-24/h5-6,9-14,17-18H,4,7-8,15-16,19H2,1-3H3