2-(3,4-dimethoxyphenyl)-1-(4-phenoxybutyl)benzimidazole

Systemtic Name: 2-(3,4-dimethoxyphenyl)-1-(4-phenoxybutyl)benzimidazole Openeye Name: 2-(3,4-dimethoxyphenyl)-1-(4-phenoxybutyl)benzimidazole CAS Name: 2-(3,4-dimethoxyphenyl)-1-(4-phenoxybutyl)benzimidazole IUPAC Name: 2-(3,4-dimethoxyphenyl)-1-(4-phenoxybutyl)benzimidazole Traditional Name: 2-(3,4-dimethoxyphenyl)-1-(4-phenoxybutyl)benzimidazole Formula: C25H26N2O3 MolecularWeight: 402.48554

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2CCCCOC4=CC=CC=C4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NC3=CC=CC=C3N2CCCCOC4=CC=CC=C4)OC

InChI

InChI=1S/C25H26N2O3/c1-28-23-15-14-19(18-24(23)29-2)25-26-21-12-6-7-13-22(21)27(25)16-8-9-17-30-20-10-4-3-5-11-20/h3-7,10-15,18H,8-9,16-17H2,1-2H3