3-[2-oxidanyl-3-(2-phenethylbenzimidazol-1-yl)propoxy]benzoic acid

Systemtic Name: 3-[2-oxidanyl-3-(2-phenethylbenzimidazol-1-yl)propoxy]benzoic acid Openeye Name: 3-[2-hydroxy-3-(2-phenethylbenzimidazol-1-yl)propoxy]benzoic acid CAS Name: 3-[2-hydroxy-3-(2-phenethyl-1-benzimidazolyl)propoxy]benzoic acid IUPAC Name: 3-[2-hydroxy-3-(2-phenethylbenzimidazol-1-yl)propoxy]benzoic acid Traditional Name: 3-[2-hydroxy-3-(2-phenethylbenzimidazol-1-yl)propoxy]benzoic acid Formula: C25H24N2O4 MolecularWeight: 416.46906

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC2=NC3=CC=CC=C3N2CC(COC4=CC=CC(=C4)C(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCC2=NC3=CC=CC=C3N2CC(COC4=CC=CC(=C4)C(=O)O)O

InChI

InChI=1S/C25H24N2O4/c28-20(17-31-21-10-6-9-19(15-21)25(29)30)16-27-23-12-5-4-11-22(23)26-24(27)14-13-18-7-2-1-3-8-18/h1-12,15,20,28H,13-14,16-17H2,(H,29,30)