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

Systemtic Name: 2-[3-[3-(4-ethanoyl-2-ethyl-5-oxidanyl-phenyl)propoxy]-2-propyl-phenoxy]benzoic acid Openeye Name: 2-[3-[3-(4-acetyl-2-ethyl-5-hydroxy-phenyl)propoxy]-2-propyl-phenoxy]benzoic acid CAS Name: 2-[3-[3-(4-acetyl-2-ethyl-5-hydroxyphenyl)propoxy]-2-propylphenoxy]benzoic acid IUPAC Name: 2-[3-[3-(4-acetyl-2-ethyl-5-hydroxyphenyl)propoxy]-2-propylphenoxy]benzoic acid Traditional Name: 2-[3-[3-(4-acetyl-2-ethyl-5-hydroxy-phenyl)propoxy]-2-propyl-phenoxy]benzoic acid Formula: C29H32O6 MolecularWeight: 476.56078

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC=C1OCCCC2=C(C=C(C(=C2)O)C(=O)C)CC)OC3=CC=CC=C3C(=O)O

Isomeric SMILES

CCCC1=C(C=CC=C1OCCCC2=C(C=C(C(=C2)O)C(=O)C)CC)OC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C29H32O6/c1-4-10-22-26(14-8-15-27(22)35-28-13-7-6-12-23(28)29(32)33)34-16-9-11-21-18-25(31)24(19(3)30)17-20(21)5-2/h6-8,12-15,17-18,31H,4-5,9-11,16H2,1-3H3,(H,32,33)