3-[4-[3-[4-(1-oxidanyl-4-phenyl-butyl)phenoxy]propoxy]phenyl]propanoic acid

Systemtic Name: 3-[4-[3-[4-(1-oxidanyl-4-phenyl-butyl)phenoxy]propoxy]phenyl]propanoic acid Openeye Name: 3-[4-[3-[4-(1-hydroxy-4-phenyl-butyl)phenoxy]propoxy]phenyl]propanoic acid CAS Name: 3-[4-[3-[4-(1-hydroxy-4-phenylbutyl)phenoxy]propoxy]phenyl]propanoic acid IUPAC Name: 3-[4-[3-[4-(1-hydroxy-4-phenylbutyl)phenoxy]propoxy]phenyl]propanoic acid Traditional Name: 3-[4-[3-[4-(1-hydroxy-4-phenyl-butyl)phenoxy]propoxy]phenyl]propionic acid Formula: C28H32O5 MolecularWeight: 448.55068

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCCC(C2=CC=C(C=C2)OCCCOC3=CC=C(C=C3)CCC(=O)O)O

Isomeric SMILES

C1=CC=C(C=C1)CCCC(C2=CC=C(C=C2)OCCCOC3=CC=C(C=C3)CCC(=O)O)O

InChI

InChI=1S/C28H32O5/c29-27(9-4-8-22-6-2-1-3-7-22)24-13-17-26(18-14-24)33-21-5-20-32-25-15-10-23(11-16-25)12-19-28(30)31/h1-3,6-7,10-11,13-18,27,29H,4-5,8-9,12,19-21H2,(H,30,31)