3-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-[3-ethoxy-4-(m-tolylmethoxy)phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-[3-ethoxy-4-[(3-methylphenyl)methoxy]phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-[3-ethoxy-4-(3-methylbenzyl)oxy-phenyl]-2-(6-methyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C27H25N3O2 MolecularWeight: 423.5063

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C=C(C#N)C2=NC3=C(N2)C=C(C=C3)C)OCC4=CC=CC(=C4)C

Isomeric SMILES

CCOC1=C(C=CC(=C1)C=C(C#N)C2=NC3=C(N2)C=C(C=C3)C)OCC4=CC=CC(=C4)C

InChI

InChI=1S/C27H25N3O2/c1-4-31-26-15-20(9-11-25(26)32-17-21-7-5-6-18(2)12-21)14-22(16-28)27-29-23-10-8-19(3)13-24(23)30-27/h5-15H,4,17H2,1-3H3,(H,29,30)