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

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 2-(3,4,5-trimethoxyphenyl)ethanoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 2-(3,4,5-trimethoxyphenyl)acetate CAS Name: 2-(3,4,5-trimethoxyphenyl)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-(3,4,5-trimethoxyphenyl)acetate Traditional Name: 2-(3,4,5-trimethoxyphenyl)acetic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H18N2O6S MolecularWeight: 390.41032

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O6S/c1-22-12-7-11(8-13(23-2)17(12)24-3)9-16(21)25-10-15-19-18(20-26-15)14-5-4-6-27-14/h4-8H,9-10H2,1-3H3