3-[[4-[(Z)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoate

Systemtic Name: 3-[[4-[(Z)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoate Openeye Name: 3-[[4-[(Z)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)vinyl]phenoxy]methyl]benzoate CAS Name: 3-[[4-[(Z)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoate IUPAC Name: 3-[[4-[(Z)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoate Traditional Name: 3-[[4-[(Z)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)vinyl]phenoxy]methyl]benzoate Formula: C25H18N3O4- MolecularWeight: 424.42812

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(N2)C(=CC3=CC=C(C=C3)OCC4=CC=CC(=C4)C(=O)[O-])C#N

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)/C(=C\C3=CC=C(C=C3)OCC4=CC=CC(=C4)C(=O)[O-])/C#N

InChI

InChI=1S/C25H19N3O4/c1-31-21-9-10-22-23(13-21)28-24(27-22)19(14-26)11-16-5-7-20(8-6-16)32-15-17-3-2-4-18(12-17)25(29)30/h2-13H,15H2,1H3,(H,27,28)(H,29,30)/p-1/b19-11-