(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-(2-methylpropoxy)benzoate

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-(2-methylpropoxy)benzoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 3-isobutoxybenzoate CAS Name: 3-(2-methylpropoxy)benzoic 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 3-(2-methylpropoxy)benzoate Traditional Name: 3-isobutoxybenzoic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H18N2O4S MolecularWeight: 358.41152

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)OCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)OCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C18H18N2O4S/c1-12(2)10-22-14-6-3-5-13(9-14)18(21)23-11-16-19-17(20-24-16)15-7-4-8-25-15/h3-9,12H,10-11H2,1-2H3