3-[[2-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-6-methoxy-phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[2-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-6-methoxy-phenoxy]methyl]benzoic acid Openeye Name: 3-[[2-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-6-methoxy-phenoxy]methyl]benzoic acid CAS Name: 3-[[2-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-6-methoxyphenoxy]methyl]benzoic acid IUPAC Name: 3-[[2-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]-6-methoxyphenoxy]methyl]benzoic acid Traditional Name: 3-[[2-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]-6-methoxy-phenoxy]methyl]benzoic acid Formula: C26H21N3O4 MolecularWeight: 439.46264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(C(=CC=C3)OC)OCC4=CC=CC(=C4)C(=O)O)C#N

Isomeric SMILES

CC1=CC2=C(C=C1)N=C(N2)C(=CC3=C(C(=CC=C3)OC)OCC4=CC=CC(=C4)C(=O)O)C#N

InChI

InChI=1S/C26H21N3O4/c1-16-9-10-21-22(11-16)29-25(28-21)20(14-27)13-18-6-4-8-23(32-2)24(18)33-15-17-5-3-7-19(12-17)26(30)31/h3-13H,15H2,1-2H3,(H,28,29)(H,30,31)