1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 3-(ethoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl 3-(ethoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(ethoxymethyl)-2-benzofurancarboxylic acid 1-[3-(3-pyridinyl)-1,2,4-oxadiazol-5-yl]ethyl ester IUPAC Name: 1-(3-pyridin-3-yl-1,2,4-oxadiazol-5-yl)ethyl 3-(ethoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(ethoxymethyl)coumarilic acid 1-[3-(3-pyridyl)-1,2,4-oxadiazol-5-yl]ethyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

CCOCC1=C(OC2=CC=CC=C21)C(=O)OC(C)C3=NC(=NO3)C4=CN=CC=C4

Isomeric SMILES

CCOCC1=C(OC2=CC=CC=C21)C(=O)OC(C)C3=NC(=NO3)C4=CN=CC=C4

InChI

InChI=1S/C21H19N3O5/c1-3-26-12-16-15-8-4-5-9-17(15)28-18(16)21(25)27-13(2)20-23-19(24-29-20)14-7-6-10-22-11-14/h4-11,13H,3,12H2,1-2H3