ethyl 3-[[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]phenyl]carbonyloxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]phenyl]carbonyloxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 3-[[[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]phenyl]-oxomethoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]benzoyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[2-[(3-methyl-1,2,4-oxadiazol-5-yl)methylthio]benzoyl]oxymethyl]coumarilic acid ethyl ester Formula: C23H20N2O6S MolecularWeight: 452.4797

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=CC=CC=C3SCC4=NC(=NO4)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=CC=CC=C3SCC4=NC(=NO4)C

InChI

InChI=1S/C23H20N2O6S/c1-3-28-23(27)21-17(15-8-4-6-10-18(15)30-21)12-29-22(26)16-9-5-7-11-19(16)32-13-20-24-14(2)25-31-20/h4-11H,3,12-13H2,1-2H3