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

Systemtic Name: 2-[[3-[3-(4-ethanoyl-2-ethyl-5-oxidanyl-phenoxy)propoxy]-2-propyl-phenoxy]methyl]benzoic acid Openeye Name: 2-[[3-[3-(4-acetyl-2-ethyl-5-hydroxy-phenoxy)propoxy]-2-propyl-phenoxy]methyl]benzoic acid CAS Name: 2-[[3-[3-(4-acetyl-2-ethyl-5-hydroxyphenoxy)propoxy]-2-propylphenoxy]methyl]benzoic acid IUPAC Name: 2-[[3-[3-(4-acetyl-2-ethyl-5-hydroxyphenoxy)propoxy]-2-propylphenoxy]methyl]benzoic acid Traditional Name: 2-[[3-[3-(4-acetyl-2-ethyl-5-hydroxy-phenoxy)propoxy]-2-propyl-phenoxy]methyl]benzoic acid Formula: C30H34O7 MolecularWeight: 506.58676

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1OCCCOC2=C(C=C(C(=C2)O)C(=O)C)CC)OCC3=CC=CC=C3C(=O)O

Isomeric SMILES

CCCC1=C(C=CC=C1OCCCOC2=C(C=C(C(=C2)O)C(=O)C)CC)OCC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C30H34O7/c1-4-10-24-27(13-8-14-28(24)37-19-22-11-6-7-12-23(22)30(33)34)35-15-9-16-36-29-18-26(32)25(20(3)31)17-21(29)5-2/h6-8,11-14,17-18,32H,4-5,9-10,15-16,19H2,1-3H3,(H,33,34)