(2-chloranyl-5-methyl-phenyl) 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate

Systemtic Name: (2-chloranyl-5-methyl-phenyl) 3-(3-thiophen-3-yl-1,2,4-oxadiazol-5-yl)propanoate Openeye Name: (2-chloro-5-methyl-phenyl) 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-chloro-5-methylphenyl) ester IUPAC Name: (2-chloro-5-methylphenyl) 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-chloro-5-methyl-phenyl) ester Formula: C16H13ClN2O3S MolecularWeight: 348.80402

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H13ClN2O3S/c1-10-2-3-12(17)13(8-10)21-15(20)5-4-14-18-16(19-22-14)11-6-7-23-9-11/h2-3,6-9H,4-5H2,1H3