(3-cyano-4-phenyl-phenyl)methyl 2-butan-2-yl-1H-benzimidazole-4-carboxylate

Systemtic Name: (3-cyano-4-phenyl-phenyl)methyl 2-butan-2-yl-1H-benzimidazole-4-carboxylate Openeye Name: (3-cyano-4-phenyl-phenyl)methyl 2-sec-butyl-1H-benzimidazole-4-carboxylate CAS Name: 2-butan-2-yl-1H-benzimidazole-4-carboxylic acid (3-cyano-4-phenylphenyl)methyl ester IUPAC Name: (3-cyano-4-phenylphenyl)methyl 2-butan-2-yl-1H-benzimidazole-4-carboxylate Traditional Name: 2-sec-butyl-1H-benzimidazole-4-carboxylic acid (3-cyano-4-phenyl-benzyl) ester Formula: C26H23N3O2 MolecularWeight: 409.47972

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=NC2=C(C=CC=C2N1)C(=O)OCC3=CC(=C(C=C3)C4=CC=CC=C4)C#N

Isomeric SMILES

CCC(C)C1=NC2=C(C=CC=C2N1)C(=O)OCC3=CC(=C(C=C3)C4=CC=CC=C4)C#N

InChI

InChI=1S/C26H23N3O2/c1-3-17(2)25-28-23-11-7-10-22(24(23)29-25)26(30)31-16-18-12-13-21(20(14-18)15-27)19-8-5-4-6-9-19/h4-14,17H,3,16H2,1-2H3,(H,28,29)