5-[(3-ethanoyl-2-methyl-benzo[g][1]benzofuran-5-yl)sulfamoyl]-2-oxidanyl-benzoic acid

Systemtic Name: 5-[(3-ethanoyl-2-methyl-benzo[g][1]benzofuran-5-yl)sulfamoyl]-2-oxidanyl-benzoic acid Openeye Name: 5-[(3-acetyl-2-methyl-benzo[g]benzofuran-5-yl)sulfamoyl]-2-hydroxy-benzoic acid CAS Name: 5-[(3-acetyl-2-methyl-5-benzo[g]benzofuranyl)sulfamoyl]-2-hydroxybenzoic acid IUPAC Name: 5-[(3-acetyl-2-methylbenzo[g][1]benzofuran-5-yl)sulfamoyl]-2-hydroxybenzoic acid Traditional Name: 5-[(3-acetyl-2-methyl-benzo[g]benzofuran-5-yl)sulfamoyl]-2-hydroxy-benzoic acid Formula: C22H17NO7S MolecularWeight: 439.43788

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC(=C(C=C4)O)C(=O)O)C(=O)C

Isomeric SMILES

CC1=C(C2=C(O1)C3=CC=CC=C3C(=C2)NS(=O)(=O)C4=CC(=C(C=C4)O)C(=O)O)C(=O)C

InChI

InChI=1S/C22H17NO7S/c1-11(24)20-12(2)30-21-15-6-4-3-5-14(15)18(10-17(20)21)23-31(28,29)13-7-8-19(25)16(9-13)22(26)27/h3-10,23,25H,1-2H3,(H,26,27)