4-[(2-methyl-3-pentoxycarbonyl-1-benzofuran-5-yl)sulfamoyl]benzoic acid

Systemtic Name: 4-[(2-methyl-3-pentoxycarbonyl-1-benzofuran-5-yl)sulfamoyl]benzoic acid Openeye Name: 4-[(2-methyl-3-pentoxycarbonyl-benzofuran-5-yl)sulfamoyl]benzoic acid CAS Name: 4-[[2-methyl-3-[oxo(pentoxy)methyl]-5-benzofuranyl]sulfamoyl]benzoic acid IUPAC Name: 4-[(2-methyl-3-pentoxycarbonyl-1-benzofuran-5-yl)sulfamoyl]benzoic acid Traditional Name: 4-[(3-amoxycarbonyl-2-methyl-benzofuran-5-yl)sulfamoyl]benzoic acid Formula: C22H23NO7S MolecularWeight: 445.48552

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O)C

Isomeric SMILES

CCCCCOC(=O)C1=C(OC2=C1C=C(C=C2)NS(=O)(=O)C3=CC=C(C=C3)C(=O)O)C

InChI

InChI=1S/C22H23NO7S/c1-3-4-5-12-29-22(26)20-14(2)30-19-11-8-16(13-18(19)20)23-31(27,28)17-9-6-15(7-10-17)21(24)25/h6-11,13,23H,3-5,12H2,1-2H3,(H,24,25)