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

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-methoxy-4-(2-methylpropoxy)benzoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 4-isobutoxy-3-methoxy-benzoate CAS Name: 3-methoxy-4-(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-methoxy-4-(2-methylpropoxy)benzoate Traditional Name: 4-isobutoxy-3-methoxy-benzoic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H20N2O5S MolecularWeight: 388.4375

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H20N2O5S/c1-12(2)10-24-14-7-6-13(9-15(14)23-3)19(22)25-11-17-20-18(21-26-17)16-5-4-8-27-16/h4-9,12H,10-11H2,1-3H3