3-[[3-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]propanoic acid

Systemtic Name: 3-[[3-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]propanoic acid Openeye Name: 3-[[3-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]propanoic acid CAS Name: 3-[[3-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-5-yl]methylthio]propanoic acid IUPAC Name: 3-[[3-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]propanoic acid Traditional Name: 3-[[3-[(4-methoxyphenoxy)methyl]-1,2,4-oxadiazol-5-yl]methylthio]propionic acid Formula: C14H16N2O5S MolecularWeight: 324.35224

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)OCC2=NOC(=N2)CSCCC(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)OCC2=NOC(=N2)CSCCC(=O)O

InChI

InChI=1S/C14H16N2O5S/c1-19-10-2-4-11(5-3-10)20-8-12-15-13(21-16-12)9-22-7-6-14(17)18/h2-5H,6-9H2,1H3,(H,17,18)