3-[2-(6-iodanylhexyl)-6-(4-methoxy-4-oxidanylidene-butoxy)phenyl]propanoic acid

Systemtic Name: 3-[2-(6-iodanylhexyl)-6-(4-methoxy-4-oxidanylidene-butoxy)phenyl]propanoic acid Openeye Name: 3-[2-(6-iodohexyl)-6-(4-methoxy-4-oxo-butoxy)phenyl]propanoic acid CAS Name: 3-[2-(6-iodohexyl)-6-(4-methoxy-4-oxobutoxy)phenyl]propanoic acid IUPAC Name: 3-[2-(6-iodohexyl)-6-(4-methoxy-4-oxobutoxy)phenyl]propanoic acid Traditional Name: 3-[2-(6-iodohexyl)-6-(4-keto-4-methoxy-butoxy)phenyl]propionic acid Formula: C20H29IO5 MolecularWeight: 476.34573

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCOC1=CC=CC(=C1CCC(=O)O)CCCCCCI

Isomeric SMILES

COC(=O)CCCOC1=CC=CC(=C1CCC(=O)O)CCCCCCI

InChI

InChI=1S/C20H29IO5/c1-25-20(24)11-7-15-26-18-10-6-9-16(8-4-2-3-5-14-21)17(18)12-13-19(22)23/h6,9-10H,2-5,7-8,11-15H2,1H3,(H,22,23)