methyl 4-[[4-[(E)-2-cyano-2-(1-methylbenzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoate

Systemtic Name: methyl 4-[[4-[(E)-2-cyano-2-(1-methylbenzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoate Openeye Name: methyl 4-[[4-[(E)-2-cyano-2-(1-methylbenzimidazol-2-yl)vinyl]phenoxy]methyl]benzoate CAS Name: 4-[[4-[(E)-2-cyano-2-(1-methyl-2-benzimidazolyl)ethenyl]phenoxy]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[4-[(E)-2-cyano-2-(1-methylbenzimidazol-2-yl)ethenyl]phenoxy]methyl]benzoate Traditional Name: 4-[[4-[(E)-2-cyano-2-(1-methylbenzimidazol-2-yl)vinyl]phenoxy]methyl]benzoic acid methyl ester Formula: C26H21N3O3 MolecularWeight: 423.46324

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=CC=CC=C2N=C1C(=CC3=CC=C(C=C3)OCC4=CC=C(C=C4)C(=O)OC)C#N

Isomeric SMILES

CN1C2=CC=CC=C2N=C1/C(=C/C3=CC=C(C=C3)OCC4=CC=C(C=C4)C(=O)OC)/C#N

InChI

InChI=1S/C26H21N3O3/c1-29-24-6-4-3-5-23(24)28-25(29)21(16-27)15-18-9-13-22(14-10-18)32-17-19-7-11-20(12-8-19)26(30)31-2/h3-15H,17H2,1-2H3/b21-15+