(2,6-dimethylphenyl) 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: (2,6-dimethylphenyl) 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: (2,6-dimethylphenyl) 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propanoate CAS Name: 3-[3-(3-thiophenyl)-1,2,4-oxadiazol-5-yl]propanoic acid (2,6-dimethylphenyl) ester IUPAC Name: (2,6-dimethylphenyl) 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Traditional Name: 3-[3-(3-thienyl)-1,2,4-oxadiazol-5-yl]propionic acid (2,6-dimethylphenyl) ester Formula: C17H16N2O3S MolecularWeight: 328.38554

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16N2O3S/c1-11-4-3-5-12(2)16(11)21-15(20)7-6-14-18-17(19-22-14)13-8-9-23-10-13/h3-5,8-10H,6-7H2,1-2H3