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

Systemtic Name: (2,6-dimethylphenyl) 3-[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]propanoate Openeye Name: (2,6-dimethylphenyl) 3-[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]propanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 3-[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]propanoate Traditional Name: 3-[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]propionic acid (2,6-dimethylphenyl) ester Formula: C21H22N2O3 MolecularWeight: 350.41098

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)OC3=C(C=CC=C3C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NOC(=N2)CCC(=O)OC3=C(C=CC=C3C)C

InChI

InChI=1S/C21H22N2O3/c1-4-16-8-10-17(11-9-16)21-22-18(26-23-21)12-13-19(24)25-20-14(2)6-5-7-15(20)3/h5-11H,4,12-13H2,1-3H3