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

Systemtic Name: 3-[2-oxidanyl-3-(2-propylbenzimidazol-1-yl)propoxy]benzoic acid Openeye Name: 3-[2-hydroxy-3-(2-propylbenzimidazol-1-yl)propoxy]benzoic acid CAS Name: 3-[2-hydroxy-3-(2-propyl-1-benzimidazolyl)propoxy]benzoic acid IUPAC Name: 3-[2-hydroxy-3-(2-propylbenzimidazol-1-yl)propoxy]benzoic acid Traditional Name: 3-[2-hydroxy-3-(2-propylbenzimidazol-1-yl)propoxy]benzoic acid Formula: C20H22N2O4 MolecularWeight: 354.39968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC=CC=C2N1CC(COC3=CC=CC(=C3)C(=O)O)O

Isomeric SMILES

CCCC1=NC2=CC=CC=C2N1CC(COC3=CC=CC(=C3)C(=O)O)O

InChI

InChI=1S/C20H22N2O4/c1-2-6-19-21-17-9-3-4-10-18(17)22(19)12-15(23)13-26-16-8-5-7-14(11-16)20(24)25/h3-5,7-11,15,23H,2,6,12-13H2,1H3,(H,24,25)