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

Systemtic Name: ethyl 3-[[4-(prop-2-ynylsulfamoyl)phenyl]carbonyloxymethyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[[4-(prop-2-ynylsulfamoyl)benzoyl]oxymethyl]benzofuran-2-carboxylate CAS Name: 3-[[oxo-[4-(prop-2-ynylsulfamoyl)phenyl]methoxy]methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[[4-(prop-2-ynylsulfamoyl)benzoyl]oxymethyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[[4-(propargylsulfamoyl)benzoyl]oxymethyl]coumarilic acid ethyl ester Formula: C22H19NO7S MolecularWeight: 441.45376

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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)S(=O)(=O)NCC#C

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)COC(=O)C3=CC=C(C=C3)S(=O)(=O)NCC#C

InChI

InChI=1S/C22H19NO7S/c1-3-13-23-31(26,27)16-11-9-15(10-12-16)21(24)29-14-18-17-7-5-6-8-19(17)30-20(18)22(25)28-4-2/h1,5-12,23H,4,13-14H2,2H3