2-[5-[2-(3-methoxy-4-oxidanyl-phenyl)ethyl]-1,3,4-oxadiazol-2-yl]ethanoate

Systemtic Name: 2-[5-[2-(3-methoxy-4-oxidanyl-phenyl)ethyl]-1,3,4-oxadiazol-2-yl]ethanoate Openeye Name: 2-[5-[2-(4-hydroxy-3-methoxy-phenyl)ethyl]-1,3,4-oxadiazol-2-yl]acetate CAS Name: 2-[5-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-1,3,4-oxadiazol-2-yl]acetate IUPAC Name: 2-[5-[2-(4-hydroxy-3-methoxyphenyl)ethyl]-1,3,4-oxadiazol-2-yl]acetate Traditional Name: 2-(5-homovanillyl-1,3,4-oxadiazol-2-yl)acetate Formula: C13H13N2O5- MolecularWeight: 277.25272

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCC2=NN=C(O2)CC(=O)[O-])O

Isomeric SMILES

COC1=C(C=CC(=C1)CCC2=NN=C(O2)CC(=O)[O-])O

InChI

InChI=1S/C13H14N2O5/c1-19-10-6-8(2-4-9(10)16)3-5-11-14-15-12(20-11)7-13(17)18/h2,4,6,16H,3,5,7H2,1H3,(H,17,18)/p-1