N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3-dihydrobenzofuran-5-sulfonamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2,3-dihydrobenzofuran-5-sulfonamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2,3-dihydro-1-benzofuran-5-sulfonamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)coumaran-5-sulfonamide Formula: C18H19ClN2O5S2 MolecularWeight: 442.93686

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCC4)Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=C(C=CC(=C2)NS(=O)(=O)C3=CC4=C(C=C3)OCC4)Cl

InChI

InChI=1S/C18H19ClN2O5S2/c19-16-5-3-14(12-18(16)28(24,25)21-8-1-2-9-21)20-27(22,23)15-4-6-17-13(11-15)7-10-26-17/h3-6,11-12,20H,1-2,7-10H2