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

Systemtic Name: 1-[4-(4-chloranyl-3,5-dimethyl-phenoxy)butyl]-2-[(3-methylphenoxy)methyl]benzimidazole Openeye Name: 1-[4-(4-chloro-3,5-dimethyl-phenoxy)butyl]-2-[(3-methylphenoxy)methyl]benzimidazole CAS Name: 1-[4-(4-chloro-3,5-dimethylphenoxy)butyl]-2-[(3-methylphenoxy)methyl]benzimidazole IUPAC Name: 1-[4-(4-chloro-3,5-dimethylphenoxy)butyl]-2-[(3-methylphenoxy)methyl]benzimidazole Traditional Name: 1-[4-(4-chloro-3,5-dimethyl-phenoxy)butyl]-2-[(3-methylphenoxy)methyl]benzimidazole Formula: C27H29ClN2O2 MolecularWeight: 448.98436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCC2=NC3=CC=CC=C3N2CCCCOC4=CC(=C(C(=C4)C)Cl)C

Isomeric SMILES

CC1=CC(=CC=C1)OCC2=NC3=CC=CC=C3N2CCCCOC4=CC(=C(C(=C4)C)Cl)C

InChI

InChI=1S/C27H29ClN2O2/c1-19-9-8-10-22(15-19)32-18-26-29-24-11-4-5-12-25(24)30(26)13-6-7-14-31-23-16-20(2)27(28)21(3)17-23/h4-5,8-12,15-17H,6-7,13-14,18H2,1-3H3