(E)-2-(1H-benzimidazol-2-yl)-3-(3-methoxy-4-phenethyloxy-phenyl)prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3-methoxy-4-phenethyloxy-phenyl)prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3-methoxy-4-phenethyloxy-phenyl)prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3-methoxy-4-phenethyloxyphenyl)-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3-methoxy-4-phenethyloxyphenyl)prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-(3-methoxy-4-phenethyloxy-phenyl)acrylonitrile Formula: C25H21N3O2 MolecularWeight: 395.45314

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=C(C#N)C2=NC3=CC=CC=C3N2)OCCC4=CC=CC=C4

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C(\C#N)/C2=NC3=CC=CC=C3N2)OCCC4=CC=CC=C4

InChI

InChI=1S/C25H21N3O2/c1-29-24-16-19(11-12-23(24)30-14-13-18-7-3-2-4-8-18)15-20(17-26)25-27-21-9-5-6-10-22(21)28-25/h2-12,15-16H,13-14H2,1H3,(H,27,28)/b20-15+