(2,6-dimethylphenyl) 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate

Systemtic Name: (2,6-dimethylphenyl) 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate Openeye Name: (2,6-dimethylphenyl) 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propanoate Traditional Name: 3-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]propionic acid (2,6-dimethylphenyl) ester Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)OC(=O)CCC2=NC(=NO2)C3=CC=C(C=C3)OC

Isomeric SMILES

CC1=C(C(=CC=C1)C)OC(=O)CCC2=NC(=NO2)C3=CC=C(C=C3)OC

InChI

InChI=1S/C20H20N2O4/c1-13-5-4-6-14(2)19(13)25-18(23)12-11-17-21-20(22-26-17)15-7-9-16(24-3)10-8-15/h4-10H,11-12H2,1-3H3