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

Systemtic Name: 2-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-3-methyl-butanoic acid Openeye Name: 2-(2,3-dihydrobenzofuran-5-ylsulfonylamino)-3-methyl-butanoic acid CAS Name: 2-(2,3-dihydrobenzofuran-5-ylsulfonylamino)-3-methylbutanoic acid IUPAC Name: 2-(2,3-dihydro-1-benzofuran-5-ylsulfonylamino)-3-methylbutanoic acid Traditional Name: 2-(coumaran-5-ylsulfonylamino)-3-methyl-butyric acid Formula: C13H17NO5S MolecularWeight: 299.34278

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO5S/c1-8(2)12(13(15)16)14-20(17,18)10-3-4-11-9(7-10)5-6-19-11/h3-4,7-8,12,14H,5-6H2,1-2H3,(H,15,16)