3-[[4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoic acid

Systemtic Name: 3-[[4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoic acid Openeye Name: 3-[[4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]phenoxy]methyl]benzoic acid CAS Name: 3-[[4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoic acid IUPAC Name: 3-[[4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoic acid Traditional Name: 3-[[4-[2-cyano-2-(6-methyl-1H-benzimidazol-2-yl)vinyl]phenoxy]methyl]benzoic acid Formula: C25H19N3O3 MolecularWeight: 409.43666

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H19N3O3/c1-16-5-10-22-23(11-16)28-24(27-22)20(14-26)12-17-6-8-21(9-7-17)31-15-18-3-2-4-19(13-18)25(29)30/h2-13H,15H2,1H3,(H,27,28)(H,29,30)