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

Systemtic Name: 1-[1-oxidanyl-2-(4-phenylmethoxyphenyl)cyclohexyl]benzimidazole-5-carboxylic acid Openeye Name: 1-[2-(4-benzyloxyphenyl)-1-hydroxy-cyclohexyl]benzimidazole-5-carboxylic acid CAS Name: 1-[1-hydroxy-2-(4-phenylmethoxyphenyl)cyclohexyl]-5-benzimidazolecarboxylic acid IUPAC Name: 1-[1-hydroxy-2-(4-phenylmethoxyphenyl)cyclohexyl]benzimidazole-5-carboxylic acid Traditional Name: 1-[2-(4-benzoxyphenyl)-1-hydroxy-cyclohexyl]benzimidazole-5-carboxylic acid Formula: C27H26N2O4 MolecularWeight: 442.50634

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C2=CC=C(C=C2)OCC3=CC=CC=C3)(N4C=NC5=C4C=CC(=C5)C(=O)O)O

Isomeric SMILES

C1CCC(C(C1)C2=CC=C(C=C2)OCC3=CC=CC=C3)(N4C=NC5=C4C=CC(=C5)C(=O)O)O

InChI

InChI=1S/C27H26N2O4/c30-26(31)21-11-14-25-24(16-21)28-18-29(25)27(32)15-5-4-8-23(27)20-9-12-22(13-10-20)33-17-19-6-2-1-3-7-19/h1-3,6-7,9-14,16,18,23,32H,4-5,8,15,17H2,(H,30,31)