2-[4-[3-carboxy-5-(pyridin-4-ylmethoxy)phenoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid

Systemtic Name: 2-[4-[3-carboxy-5-(pyridin-4-ylmethoxy)phenoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Openeye Name: 2-[4-[3-carboxy-5-(4-pyridylmethoxy)phenoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid CAS Name: 2-[4-[3-carboxy-5-(pyridin-4-ylmethoxy)phenoxy]phenyl]-1-cyclohexyl-5-benzimidazolecarboxylic acid IUPAC Name: 2-[4-[3-carboxy-5-(pyridin-4-ylmethoxy)phenoxy]phenyl]-1-cyclohexylbenzimidazole-5-carboxylic acid Traditional Name: 2-[4-[3-carboxy-5-(4-pyridylmethoxy)phenoxy]phenyl]-1-cyclohexyl-benzimidazole-5-carboxylic acid Formula: C33H29N3O6 MolecularWeight: 563.59986

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OC5=CC(=CC(=C5)C(=O)O)OCC6=CC=NC=C6

Isomeric SMILES

C1CCC(CC1)N2C3=C(C=C(C=C3)C(=O)O)N=C2C4=CC=C(C=C4)OC5=CC(=CC(=C5)C(=O)O)OCC6=CC=NC=C6

InChI

InChI=1S/C33H29N3O6/c37-32(38)23-8-11-30-29(18-23)35-31(36(30)25-4-2-1-3-5-25)22-6-9-26(10-7-22)42-28-17-24(33(39)40)16-27(19-28)41-20-21-12-14-34-15-13-21/h6-19,25H,1-5,20H2,(H,37,38)(H,39,40)