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

Systemtic Name: 3-[3-[3-(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)propoxy]phenoxy]benzoic acid Openeye Name: 3-[3-[3-(4-acetyl-2-ethyl-5-hydroxy-phenoxy)propoxy]phenoxy]benzoic acid CAS Name: 3-[3-[3-(4-acetyl-2-ethyl-5-hydroxyphenoxy)propoxy]phenoxy]benzoic acid IUPAC Name: 3-[3-[3-(4-acetyl-2-ethyl-5-hydroxyphenoxy)propoxy]phenoxy]benzoic acid Traditional Name: 3-[3-[3-(4-acetyl-2-ethyl-5-hydroxy-phenoxy)propoxy]phenoxy]benzoic acid Formula: C26H26O7 MolecularWeight: 450.48044

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C(C(=C1)C(=O)C)O)OCCCOC2=CC=CC(=C2)OC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CCC1=C(C=C(C(=C1)C(=O)C)O)OCCCOC2=CC=CC(=C2)OC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C26H26O7/c1-3-18-14-23(17(2)27)24(28)16-25(18)32-12-6-11-31-20-8-5-10-22(15-20)33-21-9-4-7-19(13-21)26(29)30/h4-5,7-10,13-16,28H,3,6,11-12H2,1-2H3,(H,29,30)