4-[butanoyl-(3-ethanoyl-2-methyl-1-benzofuran-5-yl)sulfamoyl]benzoate

Systemtic Name: 4-[butanoyl-(3-ethanoyl-2-methyl-1-benzofuran-5-yl)sulfamoyl]benzoate Openeye Name: 4-[(3-acetyl-2-methyl-benzofuran-5-yl)-butanoyl-sulfamoyl]benzoate CAS Name: 4-[(3-acetyl-2-methyl-5-benzofuranyl)-(1-oxobutyl)sulfamoyl]benzoate IUPAC Name: 4-[(3-acetyl-2-methyl-1-benzofuran-5-yl)-butanoylsulfamoyl]benzoate Traditional Name: 4-[(3-acetyl-2-methyl-benzofuran-5-yl)-butyryl-sulfamoyl]benzoate Formula: C22H20NO7S- MolecularWeight: 442.4617

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)N(C1=CC2=C(C=C1)OC(=C2C(=O)C)C)S(=O)(=O)C3=CC=C(C=C3)C(=O)[O-]

Isomeric SMILES

CCCC(=O)N(C1=CC2=C(C=C1)OC(=C2C(=O)C)C)S(=O)(=O)C3=CC=C(C=C3)C(=O)[O-]

InChI

InChI=1S/C22H21NO7S/c1-4-5-20(25)23(31(28,29)17-9-6-15(7-10-17)22(26)27)16-8-11-19-18(12-16)21(13(2)24)14(3)30-19/h6-12H,4-5H2,1-3H3,(H,26,27)/p-1