1-[4-fluoranyl-2-(4-phenylmethoxyphenyl)cyclohexyl]benzimidazole-5-carboxylic acid

Systemtic Name: 1-[4-fluoranyl-2-(4-phenylmethoxyphenyl)cyclohexyl]benzimidazole-5-carboxylic acid Openeye Name: 1-[2-(4-benzyloxyphenyl)-4-fluoro-cyclohexyl]benzimidazole-5-carboxylic acid CAS Name: 1-[4-fluoro-2-(4-phenylmethoxyphenyl)cyclohexyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-[4-fluoro-2-(4-phenylmethoxyphenyl)cyclohexyl]benzimidazole-5-carboxylic acid Traditional Name: 1-[2-(4-benzoxyphenyl)-4-fluoro-cyclohexyl]benzimidazole-5-carboxylic acid Formula: C27H25FN2O3 MolecularWeight: 444.497403

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(C(CC1F)C2=CC=C(C=C2)OCC3=CC=CC=C3)N4C=NC5=C4C=CC(=C5)C(=O)O

Isomeric SMILES

C1CC(C(CC1F)C2=CC=C(C=C2)OCC3=CC=CC=C3)N4C=NC5=C4C=CC(=C5)C(=O)O

InChI

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