1-(4-fluoranylcyclohexyl)-2-(4-phenylmethoxyphenyl)benzimidazole-5-carboxylic acid

Systemtic Name: 1-(4-fluoranylcyclohexyl)-2-(4-phenylmethoxyphenyl)benzimidazole-5-carboxylic acid Openeye Name: 2-(4-benzyloxyphenyl)-1-(4-fluorocyclohexyl)benzimidazole-5-carboxylic acid CAS Name: 1-(4-fluorocyclohexyl)-2-(4-phenylmethoxyphenyl)-5-benzimidazolecarboxylic acid IUPAC Name: 1-(4-fluorocyclohexyl)-2-(4-phenylmethoxyphenyl)benzimidazole-5-carboxylic acid Traditional Name: 2-(4-benzoxyphenyl)-1-(4-fluorocyclohexyl)benzimidazole-5-carboxylic acid Formula: C27H25FN2O3 MolecularWeight: 444.497403

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CCC1N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OCC5=CC=CC=C5)F

Isomeric SMILES

C1CC(CCC1N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OCC5=CC=CC=C5)F

InChI

InChI=1S/C27H25FN2O3/c28-21-9-11-22(12-10-21)30-25-15-8-20(27(31)32)16-24(25)29-26(30)19-6-13-23(14-7-19)33-17-18-4-2-1-3-5-18/h1-8,13-16,21-22H,9-12,17H2,(H,31,32)