2-[3-[3-[2-ethyl-4-(1H-imidazol-5-yl)-5-oxidanyl-phenoxy]propoxy]-2-propyl-phenoxy]benzoic acid

Systemtic Name: 2-[3-[3-[2-ethyl-4-(1H-imidazol-5-yl)-5-oxidanyl-phenoxy]propoxy]-2-propyl-phenoxy]benzoic acid Openeye Name: 2-[3-[3-[2-ethyl-5-hydroxy-4-(1H-imidazol-5-yl)phenoxy]propoxy]-2-propyl-phenoxy]benzoic acid CAS Name: 2-[3-[3-[2-ethyl-5-hydroxy-4-(1H-imidazol-5-yl)phenoxy]propoxy]-2-propylphenoxy]benzoic acid IUPAC Name: 2-[3-[3-[2-ethyl-5-hydroxy-4-(1H-imidazol-5-yl)phenoxy]propoxy]-2-propylphenoxy]benzoic acid Traditional Name: 2-[3-[3-[2-ethyl-5-hydroxy-4-(1H-imidazol-5-yl)phenoxy]propoxy]-2-propyl-phenoxy]benzoic acid Formula: C30H32N2O6 MolecularWeight: 516.58488

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1OCCCOC2=C(C=C(C(=C2)O)C3=CN=CN3)CC)OC4=CC=CC=C4C(=O)O

Isomeric SMILES

CCCC1=C(C=CC=C1OCCCOC2=C(C=C(C(=C2)O)C3=CN=CN3)CC)OC4=CC=CC=C4C(=O)O

InChI

InChI=1S/C30H32N2O6/c1-3-9-21-26(12-7-13-27(21)38-28-11-6-5-10-22(28)30(34)35)36-14-8-15-37-29-17-25(33)23(16-20(29)4-2)24-18-31-19-32-24/h5-7,10-13,16-19,33H,3-4,8-9,14-15H2,1-2H3,(H,31,32)(H,34,35)