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

Systemtic Name: 1-(4-oxidanylcyclohexyl)-2-(4-phenylmethoxyphenyl)benzimidazole-5-carboxylic acid Openeye Name: 2-(4-benzyloxyphenyl)-1-(4-hydroxycyclohexyl)benzimidazole-5-carboxylic acid CAS Name: 1-(4-hydroxycyclohexyl)-2-(4-phenylmethoxyphenyl)-5-benzimidazolecarboxylic acid IUPAC Name: 1-(4-hydroxycyclohexyl)-2-(4-phenylmethoxyphenyl)benzimidazole-5-carboxylic acid Traditional Name: 2-(4-benzoxyphenyl)-1-(4-hydroxycyclohexyl)benzimidazole-5-carboxylic acid Formula: C27H26N2O4 MolecularWeight: 442.50634

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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)O

Isomeric SMILES

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

InChI

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