2-[4-[(5-chloranyl-2-morpholin-4-yl-phenyl)methoxy]-2-fluoranyl-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[(5-chloranyl-2-morpholin-4-yl-phenyl)methoxy]-2-fluoranyl-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[(5-chloro-2-morpholino-phenyl)methoxy]-2-fluoro-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[[5-chloro-2-(4-morpholinyl)phenyl]methoxy]-2-fluorophenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[(5-chloro-2-morpholin-4-ylphenyl)methoxy]-2-fluorophenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-(5-chloro-2-morpholino-benzyl)oxy-2-fluoro-phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C31H31ClFN3O4 MolecularWeight: 564.046943

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=C(C=C(C=C4)OCC5=C(C=CC(=C5)Cl)N6CCOCC6)F

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=C(C=C(C=C4)OCC5=C(C=CC(=C5)Cl)N6CCOCC6)F

InChI

InChI=1S/C31H31ClFN3O4/c32-22-7-11-28(35-12-14-39-15-13-35)21(16-22)19-40-24-8-9-25(26(33)18-24)30-34-27-17-20(31(37)38)6-10-29(27)36(30)23-4-2-1-3-5-23/h6-11,16-18,23H,1-5,12-15,19H2,(H,37,38)