3-[4-(4-methoxy-4-oxidanylidene-butyl)-2-(5-oxidanylpentoxy)phenyl]propanoic acid

Systemtic Name: 3-[4-(4-methoxy-4-oxidanylidene-butyl)-2-(5-oxidanylpentoxy)phenyl]propanoic acid Openeye Name: 3-[2-(5-hydroxypentoxy)-4-(4-methoxy-4-oxo-butyl)phenyl]propanoic acid CAS Name: 3-[2-(5-hydroxypentoxy)-4-(4-methoxy-4-oxobutyl)phenyl]propanoic acid IUPAC Name: 3-[2-(5-hydroxypentoxy)-4-(4-methoxy-4-oxobutyl)phenyl]propanoic acid Traditional Name: 3-[2-(5-hydroxypentoxy)-4-(4-keto-4-methoxy-butyl)phenyl]propionic acid Formula: C19H28O6 MolecularWeight: 352.42202

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCC1=CC(=C(C=C1)CCC(=O)O)OCCCCCO

Isomeric SMILES

COC(=O)CCCC1=CC(=C(C=C1)CCC(=O)O)OCCCCCO

InChI

InChI=1S/C19H28O6/c1-24-19(23)7-5-6-15-8-9-16(10-11-18(21)22)17(14-15)25-13-4-2-3-12-20/h8-9,14,20H,2-7,10-13H2,1H3,(H,21,22)