3-[2-(5-bromanylpentoxy)-5-[2-(2-ethoxy-2-oxidanylidene-ethyl)phenyl]carbonyl-phenyl]propanoic acid

Systemtic Name: 3-[2-(5-bromanylpentoxy)-5-[2-(2-ethoxy-2-oxidanylidene-ethyl)phenyl]carbonyl-phenyl]propanoic acid Openeye Name: 3-[2-(5-bromopentoxy)-5-[2-(2-ethoxy-2-oxo-ethyl)benzoyl]phenyl]propanoic acid CAS Name: 3-[2-(5-bromopentoxy)-5-[[2-(2-ethoxy-2-oxoethyl)phenyl]-oxomethyl]phenyl]propanoic acid IUPAC Name: 3-[2-(5-bromopentoxy)-5-[2-(2-ethoxy-2-oxoethyl)benzoyl]phenyl]propanoic acid Traditional Name: 3-[2-(5-bromopentoxy)-5-[2-(2-ethoxy-2-keto-ethyl)benzoyl]phenyl]propionic acid Formula: C25H29BrO6 MolecularWeight: 505.39816

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1=CC=CC=C1C(=O)C2=CC(=C(C=C2)OCCCCCBr)CCC(=O)O

Isomeric SMILES

CCOC(=O)CC1=CC=CC=C1C(=O)C2=CC(=C(C=C2)OCCCCCBr)CCC(=O)O

InChI

InChI=1S/C25H29BrO6/c1-2-31-24(29)17-18-8-4-5-9-21(18)25(30)20-10-12-22(32-15-7-3-6-14-26)19(16-20)11-13-23(27)28/h4-5,8-10,12,16H,2-3,6-7,11,13-15,17H2,1H3,(H,27,28)