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

Systemtic Name: (3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)methyl 3-(3,4-dimethoxyphenyl)propanoate Openeye Name: [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl 3-(3,4-dimethoxyphenyl)propanoate CAS Name: 3-(3,4-dimethoxyphenyl)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-dimethoxyphenyl)propanoate Traditional Name: 3-(3,4-dimethoxyphenyl)propionic acid [3-(2-thienyl)-1,2,4-oxadiazol-5-yl]methyl ester Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N2O5S/c1-22-13-7-5-12(10-14(13)23-2)6-8-17(21)24-11-16-19-18(20-25-16)15-4-3-9-26-15/h3-5,7,9-10H,6,8,11H2,1-2H3