N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3,4-tris(fluoranyl)benzenesulfonamide

Systemtic Name: N-(4-chloranyl-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3,4-tris(fluoranyl)benzenesulfonamide Openeye Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonyl-phenyl)-2,3,4-trifluoro-benzenesulfonamide CAS Name: N-[4-chloro-3-(1-pyrrolidinylsulfonyl)phenyl]-2,3,4-trifluorobenzenesulfonamide IUPAC Name: N-(4-chloro-3-pyrrolidin-1-ylsulfonylphenyl)-2,3,4-trifluorobenzenesulfonamide Traditional Name: N-(4-chloro-3-pyrrolidinosulfonyl-phenyl)-2,3,4-trifluoro-benzenesulfonamide Formula: C16H14ClF3N2O4S2 MolecularWeight: 454.87157

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14ClF3N2O4S2/c17-11-4-3-10(9-14(11)28(25,26)22-7-1-2-8-22)21-27(23,24)13-6-5-12(18)15(19)16(13)20/h3-6,9,21H,1-2,7-8H2