2-[3-[3-(4-bromanyl-2-oxidanyl-5-propyl-phenoxy)propoxy]-4-ethanoyl-2-propyl-phenoxy]ethanoic acid

Systemtic Name: 2-[3-[3-(4-bromanyl-2-oxidanyl-5-propyl-phenoxy)propoxy]-4-ethanoyl-2-propyl-phenoxy]ethanoic acid Openeye Name: 2-[4-acetyl-3-[3-(4-bromo-2-hydroxy-5-propyl-phenoxy)propoxy]-2-propyl-phenoxy]acetic acid CAS Name: 2-[4-acetyl-3-[3-(4-bromo-2-hydroxy-5-propylphenoxy)propoxy]-2-propylphenoxy]acetic acid IUPAC Name: 2-[4-acetyl-3-[3-(4-bromo-2-hydroxy-5-propylphenoxy)propoxy]-2-propylphenoxy]acetic acid Traditional Name: 2-[4-acetyl-3-[3-(4-bromo-2-hydroxy-5-propyl-phenoxy)propoxy]-2-propyl-phenoxy]acetic acid Formula: C25H31BrO7 MolecularWeight: 523.41344

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1Br)O)OCCCOC2=C(C=CC(=C2CCC)OCC(=O)O)C(=O)C

Isomeric SMILES

CCCC1=CC(=C(C=C1Br)O)OCCCOC2=C(C=CC(=C2CCC)OCC(=O)O)C(=O)C

InChI

InChI=1S/C25H31BrO7/c1-4-7-17-13-23(21(28)14-20(17)26)31-11-6-12-32-25-18(16(3)27)9-10-22(19(25)8-5-2)33-15-24(29)30/h9-10,13-14,28H,4-8,11-12,15H2,1-3H3,(H,29,30)