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

Systemtic Name: 4-[3-(3-methoxy-4-phenylmethoxy-phenyl)-1,2,4-oxadiazol-5-yl]butanoic acid Openeye Name: 4-[3-(4-benzyloxy-3-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]butanoic acid CAS Name: 4-[3-(3-methoxy-4-phenylmethoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoic acid IUPAC Name: 4-[3-(3-methoxy-4-phenylmethoxyphenyl)-1,2,4-oxadiazol-5-yl]butanoic acid Traditional Name: 4-[3-(4-benzoxy-3-methoxy-phenyl)-1,2,4-oxadiazol-5-yl]butyric acid Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H20N2O5/c1-25-17-12-15(20-21-18(27-22-20)8-5-9-19(23)24)10-11-16(17)26-13-14-6-3-2-4-7-14/h2-4,6-7,10-12H,5,8-9,13H2,1H3,(H,23,24)