4-[3-[3-(3-bromanylpropoxy)propoxy]-4-ethanoyl-2-propyl-phenoxy]butanoic acid

Systemtic Name: 4-[3-[3-(3-bromanylpropoxy)propoxy]-4-ethanoyl-2-propyl-phenoxy]butanoic acid Openeye Name: 4-[4-acetyl-3-[3-(3-bromopropoxy)propoxy]-2-propyl-phenoxy]butanoic acid CAS Name: 4-[4-acetyl-3-[3-(3-bromopropoxy)propoxy]-2-propylphenoxy]butanoic acid IUPAC Name: 4-[4-acetyl-3-[3-(3-bromopropoxy)propoxy]-2-propylphenoxy]butanoic acid Traditional Name: 4-[4-acetyl-3-[3-(3-bromopropoxy)propoxy]-2-propyl-phenoxy]butyric acid Formula: C21H31BrO6 MolecularWeight: 459.37124

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1OCCCOCCCBr)C(=O)C)OCCCC(=O)O

Isomeric SMILES

CCCC1=C(C=CC(=C1OCCCOCCCBr)C(=O)C)OCCCC(=O)O

InChI

InChI=1S/C21H31BrO6/c1-3-7-18-19(27-14-4-8-20(24)25)10-9-17(16(2)23)21(18)28-15-6-13-26-12-5-11-22/h9-10H,3-8,11-15H2,1-2H3,(H,24,25)