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

Systemtic Name: 5-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfamoyl]thiophene-3-carboxylic acid Openeye Name: 5-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfamoyl]thiophene-3-carboxylic acid CAS Name: 5-[(5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methylsulfamoyl]-3-thiophenecarboxylic acid IUPAC Name: 5-[(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methylsulfamoyl]thiophene-3-carboxylic acid Traditional Name: 5-[(5-ethoxy-2-methyl-coumaran-6-yl)methylsulfamoyl]-3-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=CC(=CS3)C(=O)O

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)CNS(=O)(=O)C3=CC(=CS3)C(=O)O

InChI

InChI=1S/C17H19NO6S2/c1-3-23-14-5-11-4-10(2)24-15(11)6-12(14)8-18-26(21,22)16-7-13(9-25-16)17(19)20/h5-7,9-10,18H,3-4,8H2,1-2H3,(H,19,20)