(2-cyanophenyl)methyl 3-[(2-cyanophenyl)methyl]-2-methyl-benzimidazole-5-carboxylate

Systemtic Name: (2-cyanophenyl)methyl 3-[(2-cyanophenyl)methyl]-2-methyl-benzimidazole-5-carboxylate Openeye Name: (2-cyanophenyl)methyl 3-[(2-cyanophenyl)methyl]-2-methyl-benzimidazole-5-carboxylate CAS Name: 3-[(2-cyanophenyl)methyl]-2-methyl-5-benzimidazolecarboxylic acid (2-cyanophenyl)methyl ester IUPAC Name: (2-cyanophenyl)methyl 3-[(2-cyanophenyl)methyl]-2-methylbenzimidazole-5-carboxylate Traditional Name: 3-(2-cyanobenzyl)-2-methyl-benzimidazole-5-carboxylic acid (2-cyanobenzyl) ester Formula: C25H18N4O2 MolecularWeight: 406.43602

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1CC3=CC=CC=C3C#N)C=C(C=C2)C(=O)OCC4=CC=CC=C4C#N

Isomeric SMILES

CC1=NC2=C(N1CC3=CC=CC=C3C#N)C=C(C=C2)C(=O)OCC4=CC=CC=C4C#N

InChI

InChI=1S/C25H18N4O2/c1-17-28-23-11-10-18(25(30)31-16-22-9-5-3-7-20(22)14-27)12-24(23)29(17)15-21-8-4-2-6-19(21)13-26/h2-12H,15-16H2,1H3