2-[2-[2-(4-chlorophenyl)-5-fluoranyl-phenyl]quinolin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[2-[2-(4-chlorophenyl)-5-fluoranyl-phenyl]quinolin-6-yl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[2-[2-(4-chlorophenyl)-5-fluoro-phenyl]-6-quinolyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[2-[2-(4-chlorophenyl)-5-fluorophenyl]-6-quinolinyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[2-[2-(4-chlorophenyl)-5-fluorophenyl]quinolin-6-yl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[2-[2-(4-chlorophenyl)-5-fluoro-phenyl]-6-quinolyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C35H27ClFN3O2 MolecularWeight: 576.059183

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=C(C=CC(=C6)F)C7=CC=C(C=C7)Cl

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC5=C(C=C4)N=C(C=C5)C6=C(C=CC(=C6)F)C7=CC=C(C=C7)Cl

InChI

InChI=1S/C35H27ClFN3O2/c36-25-11-6-21(7-12-25)28-14-13-26(37)20-29(28)31-16-8-22-18-23(9-15-30(22)38-31)34-39-32-19-24(35(41)42)10-17-33(32)40(34)27-4-2-1-3-5-27/h6-20,27H,1-5H2,(H,41,42)