2-[(4-tert-butylphenoxy)methyl]-1-[2-(4-chloranyl-3-methyl-phenoxy)ethyl]benzimidazole

Systemtic Name: 2-[(4-tert-butylphenoxy)methyl]-1-[2-(4-chloranyl-3-methyl-phenoxy)ethyl]benzimidazole Openeye Name: 2-[(4-tert-butylphenoxy)methyl]-1-[2-(4-chloro-3-methyl-phenoxy)ethyl]benzimidazole CAS Name: 2-[(4-tert-butylphenoxy)methyl]-1-[2-(4-chloro-3-methylphenoxy)ethyl]benzimidazole IUPAC Name: 2-[(4-tert-butylphenoxy)methyl]-1-[2-(4-chloro-3-methylphenoxy)ethyl]benzimidazole Traditional Name: 2-[(4-tert-butylphenoxy)methyl]-1-[2-(4-chloro-3-methyl-phenoxy)ethyl]benzimidazole Formula: C27H29ClN2O2 MolecularWeight: 448.98436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCN2C3=CC=CC=C3N=C2COC4=CC=C(C=C4)C(C)(C)C)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCN2C3=CC=CC=C3N=C2COC4=CC=C(C=C4)C(C)(C)C)Cl

InChI

InChI=1S/C27H29ClN2O2/c1-19-17-22(13-14-23(19)28)31-16-15-30-25-8-6-5-7-24(25)29-26(30)18-32-21-11-9-20(10-12-21)27(2,3)4/h5-14,17H,15-16,18H2,1-4H3