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

Systemtic Name: 1-[4-(4-chloranyl-3,5-dimethyl-phenoxy)butyl]-2-[(4-methoxyphenoxy)methyl]benzimidazole Openeye Name: 1-[4-(4-chloro-3,5-dimethyl-phenoxy)butyl]-2-[(4-methoxyphenoxy)methyl]benzimidazole CAS Name: 1-[4-(4-chloro-3,5-dimethylphenoxy)butyl]-2-[(4-methoxyphenoxy)methyl]benzimidazole IUPAC Name: 1-[4-(4-chloro-3,5-dimethylphenoxy)butyl]-2-[(4-methoxyphenoxy)methyl]benzimidazole Traditional Name: 1-[4-(4-chloro-3,5-dimethyl-phenoxy)butyl]-2-[(4-methoxyphenoxy)methyl]benzimidazole Formula: C27H29ClN2O3 MolecularWeight: 464.98376

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1Cl)C)OCCCCN2C3=CC=CC=C3N=C2COC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC(=CC(=C1Cl)C)OCCCCN2C3=CC=CC=C3N=C2COC4=CC=C(C=C4)OC

InChI

InChI=1S/C27H29ClN2O3/c1-19-16-23(17-20(2)27(19)28)32-15-7-6-14-30-25-9-5-4-8-24(25)29-26(30)18-33-22-12-10-21(31-3)11-13-22/h4-5,8-13,16-17H,6-7,14-15,18H2,1-3H3