3-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfamoyl]thiophene-2-carboxylic acid

Systemtic Name: 3-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfamoyl]thiophene-2-carboxylic acid Openeye Name: 3-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfamoyl]thiophene-2-carboxylic acid CAS Name: 3-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfamoyl]-2-thiophenecarboxylic acid IUPAC Name: 3-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfamoyl]thiophene-2-carboxylic acid Traditional Name: 3-[(5-ethoxy-2-methyl-coumaran-6-yl)methylsulfamoyl]-2-thenoic acid Formula: C17H19NO6S2 MolecularWeight: 397.46586

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)CNS(=O)(=O)C3=C(SC=C3)C(=O)O

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CNS(=O)(=O)C3=C(SC=C3)C(=O)O

InChI

InChI=1S/C17H19NO6S2/c1-3-23-13-7-11-6-10(2)24-14(11)8-12(13)9-18-26(21,22)15-4-5-25-16(15)17(19)20/h4-5,7-8,10,18H,3,6,9H2,1-2H3,(H,19,20)