1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)pyrrolidine-2-carboxylic acid Openeye Name: 1-(2,3-dihydrobenzofuran-5-ylsulfonyl)pyrrolidine-2-carboxylic acid CAS Name: 1-(2,3-dihydrobenzofuran-5-ylsulfonyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(2,3-dihydro-1-benzofuran-5-ylsulfonyl)pyrrolidine-2-carboxylic acid Traditional Name: 1-coumaran-5-ylsulfonylproline Formula: C13H15NO5S MolecularWeight: 297.3269

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)OCC3)C(=O)O

Isomeric SMILES

C1CC(N(C1)S(=O)(=O)C2=CC3=C(C=C2)OCC3)C(=O)O

InChI

InChI=1S/C13H15NO5S/c15-13(16)11-2-1-6-14(11)20(17,18)10-3-4-12-9(8-10)5-7-19-12/h3-4,8,11H,1-2,5-7H2,(H,15,16)