3-[3-(3-methoxy-4-phenylmethoxy-phenyl)-1,2,4-oxadiazol-5-yl]propanoic acid

Systemtic Name: 3-[3-(3-methoxy-4-phenylmethoxy-phenyl)-1,2,4-oxadiazol-5-yl]propanoic acid Openeye Name: 3-[3-(4-benzyloxy-3-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]propanoic acid CAS Name: 3-[3-(3-methoxy-4-phenylmethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid IUPAC Name: 3-[3-(3-methoxy-4-phenylmethoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid Traditional Name: 3-[3-(4-benzoxy-3-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]propionic acid Formula: C19H18N2O5 MolecularWeight: 354.35662

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C2=NOC(=N2)CCC(=O)O)OCC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)C2=NOC(=N2)CCC(=O)O)OCC3=CC=CC=C3

InChI

InChI=1S/C19H18N2O5/c1-24-16-11-14(19-20-17(26-21-19)9-10-18(22)23)7-8-15(16)25-12-13-5-3-2-4-6-13/h2-8,11H,9-10,12H2,1H3,(H,22,23)