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

Systemtic Name: (3-cyano-4-phenyl-phenyl)methyl 2-propan-2-yl-1H-benzimidazole-4-carboxylate Openeye Name: (3-cyano-4-phenyl-phenyl)methyl 2-isopropyl-1H-benzimidazole-4-carboxylate CAS Name: 2-propan-2-yl-1H-benzimidazole-4-carboxylic acid (3-cyano-4-phenylphenyl)methyl ester IUPAC Name: (3-cyano-4-phenylphenyl)methyl 2-propan-2-yl-1H-benzimidazole-4-carboxylate Traditional Name: 2-isopropyl-1H-benzimidazole-4-carboxylic acid (3-cyano-4-phenyl-benzyl) ester Formula: C25H21N3O2 MolecularWeight: 395.45314

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H21N3O2/c1-16(2)24-27-22-10-6-9-21(23(22)28-24)25(29)30-15-17-11-12-20(19(13-17)14-26)18-7-4-3-5-8-18/h3-13,16H,15H2,1-2H3,(H,27,28)