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

Systemtic Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfamoyl]thiophene-2-carboxylate Openeye Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylsulfamoyl]thiophene-2-carboxylate CAS Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl]methylsulfamoyl]-2-thiophenecarboxylate IUPAC Name: 3-[[(2S)-5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl]methylsulfamoyl]thiophene-2-carboxylate Traditional Name: 3-[[(2S)-5-ethoxy-2-methyl-coumaran-6-yl]methylsulfamoyl]-2-thenoate Formula: C17H18NO6S2- MolecularWeight: 396.45792

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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)C[C@@H](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)/p-1/t10-/m0/s1