ethyl 3-[[4-(methylsulfonylmethyl)phenyl]carbonyloxymethyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[4-(methylsulfonylmethyl)phenyl]carbonyloxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[4-(methylsulfonylmethyl)benzoyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 3-[[[4-(methylsulfonylmethyl)phenyl]-oxomethoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[4-(methylsulfonylmethyl)benzoyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[4-(mesylmethyl)benzoyl]oxymethyl]coumarilic acid ethyl ester Formula: C21H20O7S MolecularWeight: 416.4443

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=CC=C(C=C3)CS(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=CC=C(C=C3)CS(=O)(=O)C

InChI

InChI=1S/C21H20O7S/c1-3-26-21(23)19-17(16-6-4-5-7-18(16)28-19)12-27-20(22)15-10-8-14(9-11-15)13-29(2,24)25/h4-11H,3,12-13H2,1-2H3