2-chloranyl-5-[(3-ethoxycarbonyl-2-methyl-1-benzofuran-5-yl)sulfamoyl]benzoic acid

Systemtic Name: 2-chloranyl-5-[(3-ethoxycarbonyl-2-methyl-1-benzofuran-5-yl)sulfamoyl]benzoic acid Openeye Name: 2-chloro-5-[(3-ethoxycarbonyl-2-methyl-benzofuran-5-yl)sulfamoyl]benzoic acid CAS Name: 2-chloro-5-[(3-ethoxycarbonyl-2-methyl-5-benzofuranyl)sulfamoyl]benzoic acid IUPAC Name: 2-chloro-5-[(3-ethoxycarbonyl-2-methyl-1-benzofuran-5-yl)sulfamoyl]benzoic acid Traditional Name: 5-[(3-carbethoxy-2-methyl-benzofuran-5-yl)sulfamoyl]-2-chloro-benzoic acid Formula: C19H16ClNO7S MolecularWeight: 437.85084

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H16ClNO7S/c1-3-27-19(24)17-10(2)28-16-7-4-11(8-14(16)17)21-29(25,26)12-5-6-15(20)13(9-12)18(22)23/h4-9,21H,3H2,1-2H3,(H,22,23)