ethyl 2-chloranyl-3-[[4-(2-cyanophenyl)phenyl]methyl]benzimidazole-4-carboxylate

Systemtic Name: ethyl 2-chloranyl-3-[[4-(2-cyanophenyl)phenyl]methyl]benzimidazole-4-carboxylate Openeye Name: ethyl 2-chloro-3-[[4-(2-cyanophenyl)phenyl]methyl]benzimidazole-4-carboxylate CAS Name: 2-chloro-3-[[4-(2-cyanophenyl)phenyl]methyl]-4-benzimidazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-chloro-3-[[4-(2-cyanophenyl)phenyl]methyl]benzimidazole-4-carboxylate Traditional Name: 2-chloro-3-[4-(2-cyanophenyl)benzyl]benzimidazole-4-carboxylic acid ethyl ester Formula: C24H18ClN3O2 MolecularWeight: 415.87162

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C2C(=CC=C1)N=C(N2CC3=CC=C(C=C3)C4=CC=CC=C4C#N)Cl

Isomeric SMILES

CCOC(=O)C1=C2C(=CC=C1)N=C(N2CC3=CC=C(C=C3)C4=CC=CC=C4C#N)Cl

InChI

InChI=1S/C24H18ClN3O2/c1-2-30-23(29)20-8-5-9-21-22(20)28(24(25)27-21)15-16-10-12-17(13-11-16)19-7-4-3-6-18(19)14-26/h3-13H,2,15H2,1H3