(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-(4-propanoylphenoxy)ethanoate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-(4-propanoylphenoxy)ethanoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 2-(4-propanoylphenoxy)acetate CAS Name: 2-[4-(1-oxopropyl)phenoxy]acetic acid (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl ester IUPAC Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-(4-propanoylphenoxy)acetate Traditional Name: 2-(4-propionylphenoxy)acetic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H16N2O5S MolecularWeight: 372.39504

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC=C(C=C1)OCC(=O)OCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

CCC(=O)C1=CC=C(C=C1)OCC(=O)OCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C18H16N2O5S/c1-2-14(21)12-5-7-13(8-6-12)23-11-17(22)24-10-16-19-18(20-25-16)15-4-3-9-26-15/h3-9H,2,10-11H2,1H3