2-[3-[3-(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)propoxy]-2-propyl-phenoxy]butanoic acid

Systemtic Name: 2-[3-[3-(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)propoxy]-2-propyl-phenoxy]butanoic acid Openeye Name: 2-[3-[3-(4-acetyl-2-ethyl-5-hydroxy-phenoxy)propoxy]-2-propyl-phenoxy]butanoic acid CAS Name: 2-[3-[3-(4-acetyl-2-ethyl-5-hydroxyphenoxy)propoxy]-2-propylphenoxy]butanoic acid IUPAC Name: 2-[3-[3-(4-acetyl-2-ethyl-5-hydroxyphenoxy)propoxy]-2-propylphenoxy]butanoic acid Traditional Name: 2-[3-[3-(4-acetyl-2-ethyl-5-hydroxy-phenoxy)propoxy]-2-propyl-phenoxy]butyric acid Formula: C26H34O7 MolecularWeight: 458.54396

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1OC(CC)C(=O)O)OCCCOC2=C(C=C(C(=C2)O)C(=O)C)CC

Isomeric SMILES

CCCC1=C(C=CC=C1OC(CC)C(=O)O)OCCCOC2=C(C=C(C(=C2)O)C(=O)C)CC

InChI

InChI=1S/C26H34O7/c1-5-10-19-23(11-8-12-24(19)33-22(7-3)26(29)30)31-13-9-14-32-25-16-21(28)20(17(4)27)15-18(25)6-2/h8,11-12,15-16,22,28H,5-7,9-10,13-14H2,1-4H3,(H,29,30)