4-[[4-(4-octoxyphenyl)phenoxy]methyl]benzoic acid

Systemtic Name: 4-[[4-(4-octoxyphenyl)phenoxy]methyl]benzoic acid Openeye Name: 4-[[4-(4-octoxyphenyl)phenoxy]methyl]benzoic acid CAS Name: 4-[[4-(4-octoxyphenyl)phenoxy]methyl]benzoic acid IUPAC Name: 4-[[4-(4-octoxyphenyl)phenoxy]methyl]benzoic acid Traditional Name: 4-[[4-(4-octoxyphenyl)phenoxy]methyl]benzoic acid Formula: C28H32O4 MolecularWeight: 432.55128

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)OCC3=CC=C(C=C3)C(=O)O

InChI

InChI=1S/C28H32O4/c1-2-3-4-5-6-7-20-31-26-16-12-23(13-17-26)24-14-18-27(19-15-24)32-21-22-8-10-25(11-9-22)28(29)30/h8-19H,2-7,20-21H2,1H3,(H,29,30)