3-[5-(4-methoxy-4-oxidanylidene-butoxy)-2-(6-oxidanylhexyl)phenyl]propanoic acid

Systemtic Name: 3-[5-(4-methoxy-4-oxidanylidene-butoxy)-2-(6-oxidanylhexyl)phenyl]propanoic acid Openeye Name: 3-[2-(6-hydroxyhexyl)-5-(4-methoxy-4-oxo-butoxy)phenyl]propanoic acid CAS Name: 3-[2-(6-hydroxyhexyl)-5-(4-methoxy-4-oxobutoxy)phenyl]propanoic acid IUPAC Name: 3-[2-(6-hydroxyhexyl)-5-(4-methoxy-4-oxobutoxy)phenyl]propanoic acid Traditional Name: 3-[2-(6-hydroxyhexyl)-5-(4-keto-4-methoxy-butoxy)phenyl]propionic acid Formula: C20H30O6 MolecularWeight: 366.4486

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCCOC1=CC(=C(C=C1)CCCCCCO)CCC(=O)O

Isomeric SMILES

COC(=O)CCCOC1=CC(=C(C=C1)CCCCCCO)CCC(=O)O

InChI

InChI=1S/C20H30O6/c1-25-20(24)8-6-14-26-18-11-9-16(7-4-2-3-5-13-21)17(15-18)10-12-19(22)23/h9,11,15,21H,2-8,10,12-14H2,1H3,(H,22,23)