2-[4-[3-[2-[(4-methylphenoxy)methyl]benzimidazol-1-yl]-2-oxidanyl-propoxy]phenyl]ethanenitrile

Systemtic Name: 2-[4-[3-[2-[(4-methylphenoxy)methyl]benzimidazol-1-yl]-2-oxidanyl-propoxy]phenyl]ethanenitrile Openeye Name: 2-[4-[2-hydroxy-3-[2-[(4-methylphenoxy)methyl]benzimidazol-1-yl]propoxy]phenyl]acetonitrile CAS Name: 2-[4-[2-hydroxy-3-[2-[(4-methylphenoxy)methyl]-1-benzimidazolyl]propoxy]phenyl]acetonitrile IUPAC Name: 2-[4-[2-hydroxy-3-[2-[(4-methylphenoxy)methyl]benzimidazol-1-yl]propoxy]phenyl]acetonitrile Traditional Name: 2-[4-[2-hydroxy-3-[2-[(4-methylphenoxy)methyl]benzimidazol-1-yl]propoxy]phenyl]acetonitrile Formula: C26H25N3O3 MolecularWeight: 427.495

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CC(COC4=CC=C(C=C4)CC#N)O

Isomeric SMILES

CC1=CC=C(C=C1)OCC2=NC3=CC=CC=C3N2CC(COC4=CC=C(C=C4)CC#N)O

InChI

InChI=1S/C26H25N3O3/c1-19-6-10-22(11-7-19)32-18-26-28-24-4-2-3-5-25(24)29(26)16-21(30)17-31-23-12-8-20(9-13-23)14-15-27/h2-13,21,30H,14,16-18H2,1H3