2-[4-[[2-(3-chloranyl-4-fluoranyl-phenyl)-5-(propan-2-ylcarbamoyl)phenyl]methoxy]-2-fluoranyl-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[[2-(3-chloranyl-4-fluoranyl-phenyl)-5-(propan-2-ylcarbamoyl)phenyl]methoxy]-2-fluoranyl-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[[2-(3-chloro-4-fluoro-phenyl)-5-(isopropylcarbamoyl)phenyl]methoxy]-2-fluoro-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[[2-(3-chloro-4-fluorophenyl)-5-[oxo-(propan-2-ylamino)methyl]phenyl]methoxy]-2-fluorophenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[[2-(3-chloro-4-fluorophenyl)-5-(propan-2-ylcarbamoyl)phenyl]methoxy]-2-fluorophenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-[2-(3-chloro-4-fluoro-phenyl)-5-(isopropylcarbamoyl)benzyl]oxy-2-fluoro-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C37H34ClF2N3O4 MolecularWeight: 658.133366

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C1=CC(=C(C=C1)C2=CC(=C(C=C2)F)Cl)COC3=CC(=C(C=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O)F

Isomeric SMILES

CC(C)NC(=O)C1=CC(=C(C=C1)C2=CC(=C(C=C2)F)Cl)COC3=CC(=C(C=C3)C4=NC5=C(N4C6CCCCC6)C=CC(=C5)C(=O)O)F

InChI

InChI=1S/C37H34ClF2N3O4/c1-21(2)41-36(44)23-8-12-28(22-9-14-31(39)30(38)17-22)25(16-23)20-47-27-11-13-29(32(40)19-27)35-42-33-18-24(37(45)46)10-15-34(33)43(35)26-6-4-3-5-7-26/h8-19,21,26H,3-7,20H2,1-2H3,(H,41,44)(H,45,46)