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

Systemtic Name: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3,4,5-triethoxybenzoate Openeye Name: [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid [5-(3-thiophenyl)-1,2,4-oxadiazol-3-yl]methyl ester IUPAC Name: (5-thiophen-3-yl-1,2,4-oxadiazol-3-yl)methyl 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid [5-(3-thienyl)-1,2,4-oxadiazol-3-yl]methyl ester Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC2=NOC(=N2)C3=CSC=C3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC2=NOC(=N2)C3=CSC=C3

InChI

InChI=1S/C20H22N2O6S/c1-4-24-15-9-14(10-16(25-5-2)18(15)26-6-3)20(23)27-11-17-21-19(28-22-17)13-7-8-29-12-13/h7-10,12H,4-6,11H2,1-3H3