6,7-bis(chloranyl)-5-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1-benzofuran-2-carboxylic acid

Systemtic Name: 6,7-bis(chloranyl)-5-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1-benzofuran-2-carboxylic acid Openeye Name: 6,7-dichloro-5-pyrrolidin-1-ylsulfonyl-2,3-dihydrobenzofuran-2-carboxylic acid CAS Name: 6,7-dichloro-5-(1-pyrrolidinylsulfonyl)-2,3-dihydrobenzofuran-2-carboxylic acid IUPAC Name: 6,7-dichloro-5-pyrrolidin-1-ylsulfonyl-2,3-dihydro-1-benzofuran-2-carboxylic acid Traditional Name: 6,7-dichloro-5-pyrrolidinosulfonyl-coumaran-2-carboxylic acid Formula: C13H13Cl2NO5S MolecularWeight: 366.21702

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C(=C3C(=C2)CC(O3)C(=O)O)Cl)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C(=C3C(=C2)CC(O3)C(=O)O)Cl)Cl

InChI

InChI=1S/C13H13Cl2NO5S/c14-10-9(22(19,20)16-3-1-2-4-16)6-7-5-8(13(17)18)21-12(7)11(10)15/h6,8H,1-5H2,(H,17,18)