3-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-[4-[(2-chlorophenyl)methoxy]phenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-[4-(2-chlorobenzyl)oxyphenyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C25H20ClN3O MolecularWeight: 413.8988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C(=CC3=CC=C(C=C3)OCC4=CC=CC=C4Cl)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C(=CC3=CC=C(C=C3)OCC4=CC=CC=C4Cl)C#N

InChI

InChI=1S/C25H20ClN3O/c1-16-11-23-24(12-17(16)2)29-25(28-23)20(14-27)13-18-7-9-21(10-8-18)30-15-19-5-3-4-6-22(19)26/h3-13H,15H2,1-2H3,(H,28,29)