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

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-(3,4,5-trimethoxyphenyl)propanoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 3-(3,4,5-trimethoxyphenyl)propanoate CAS Name: 3-(3,4,5-trimethoxyphenyl)propanoic 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-(3,4,5-trimethoxyphenyl)propanoate Traditional Name: 3-(3,4,5-trimethoxyphenyl)propionic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C19H20N2O6S MolecularWeight: 404.4369

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=NC(=NO2)C3=CC=CS3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)CCC(=O)OCC2=NC(=NO2)C3=CC=CS3

InChI

InChI=1S/C19H20N2O6S/c1-23-13-9-12(10-14(24-2)18(13)25-3)6-7-17(22)26-11-16-20-19(21-27-16)15-5-4-8-28-15/h4-5,8-10H,6-7,11H2,1-3H3