3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)butanoic acid

Systemtic Name: 3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)butanoic acid Openeye Name: 3-(2,3-dihydrobenzofuran-5-ylsulfonylamino)butanoic acid CAS Name: 3-(2,3-dihydrobenzofuran-5-ylsulfonylamino)butanoic acid IUPAC Name: 3-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)butanoic acid Traditional Name: 3-(coumaran-5-ylsulfonylamino)butyric acid Formula: C12H15NO5S MolecularWeight: 285.3162

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)OCC2

Isomeric SMILES

CC(CC(=O)O)NS(=O)(=O)C1=CC2=C(C=C1)OCC2

InChI

InChI=1S/C12H15NO5S/c1-8(6-12(14)15)13-19(16,17)10-2-3-11-9(7-10)4-5-18-11/h2-3,7-8,13H,4-6H2,1H3,(H,14,15)