3-[2-[3-(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)propoxy]-5-phenyl-phenyl]propanoic acid

Systemtic Name: 3-[2-[3-(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)propoxy]-5-phenyl-phenyl]propanoic acid Openeye Name: 3-[2-[3-(4-acetyl-2-ethyl-5-hydroxy-phenoxy)propoxy]-5-phenyl-phenyl]propanoic acid CAS Name: 3-[2-[3-(4-acetyl-2-ethyl-5-hydroxyphenoxy)propoxy]-5-phenylphenyl]propanoic acid IUPAC Name: 3-[2-[3-(4-acetyl-2-ethyl-5-hydroxyphenoxy)propoxy]-5-phenylphenyl]propanoic acid Traditional Name: 3-[2-[3-(4-acetyl-2-ethyl-5-hydroxy-phenoxy)propoxy]-5-phenyl-phenyl]propionic acid Formula: C28H30O6 MolecularWeight: 462.5342

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C(=O)C)O)OCCCOC2=C(C=C(C=C2)C3=CC=CC=C3)CCC(=O)O

Isomeric SMILES

CCC1=C(C=C(C(=C1)C(=O)C)O)OCCCOC2=C(C=C(C=C2)C3=CC=CC=C3)CCC(=O)O

InChI

InChI=1S/C28H30O6/c1-3-20-17-24(19(2)29)25(30)18-27(20)34-15-7-14-33-26-12-10-22(21-8-5-4-6-9-21)16-23(26)11-13-28(31)32/h4-6,8-10,12,16-18,30H,3,7,11,13-15H2,1-2H3,(H,31,32)