2-[4-[[2-(4-chlorophenyl)-5-[ethyl(methyl)carbamoyl]phenyl]methoxy]-2-fluoranyl-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[[2-(4-chlorophenyl)-5-[ethyl(methyl)carbamoyl]phenyl]methoxy]-2-fluoranyl-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[[2-(4-chlorophenyl)-5-[ethyl(methyl)carbamoyl]phenyl]methoxy]-2-fluoro-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[[2-(4-chlorophenyl)-5-[[ethyl(methyl)amino]-oxomethyl]phenyl]methoxy]-2-fluorophenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[[2-(4-chlorophenyl)-5-[ethyl(methyl)carbamoyl]phenyl]methoxy]-2-fluorophenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-[2-(4-chlorophenyl)-5-[ethyl(methyl)carbamoyl]benzyl]oxy-2-fluoro-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C37H35ClFN3O4 MolecularWeight: 640.142903

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C37H35ClFN3O4/c1-3-41(2)36(43)24-11-16-30(23-9-13-27(38)14-10-23)26(19-24)22-46-29-15-17-31(32(39)21-29)35-40-33-20-25(37(44)45)12-18-34(33)42(35)28-7-5-4-6-8-28/h9-21,28H,3-8,22H2,1-2H3,(H,44,45)