4-[[4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]-2-methoxy-phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]-2-methoxy-phenoxy]methyl]benzoic acid Openeye Name: 4-[[4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)vinyl]-2-methoxy-phenoxy]methyl]benzoic acid CAS Name: 4-[[4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]-2-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)ethenyl]-2-methoxyphenoxy]methyl]benzoic acid Traditional Name: 4-[[4-[(E)-2-cyano-2-(6-methoxy-1H-benzimidazol-2-yl)vinyl]-2-methoxy-phenoxy]methyl]benzoic acid Formula: C26H21N3O5 MolecularWeight: 455.46204

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(N2)/C(=C/C3=CC(=C(C=C3)OCC4=CC=C(C=C4)C(=O)O)OC)/C#N

InChI

InChI=1S/C26H21N3O5/c1-32-20-8-9-21-22(13-20)29-25(28-21)19(14-27)11-17-5-10-23(24(12-17)33-2)34-15-16-3-6-18(7-4-16)26(30)31/h3-13H,15H2,1-2H3,(H,28,29)(H,30,31)/b19-11+