3-cyano-4-fluoranyl-N-[2-(5-oxidanyl-1,3-benzodioxol-4-yl)phenyl]benzenesulfonamide

Systemtic Name: 3-cyano-4-fluoranyl-N-[2-(5-oxidanyl-1,3-benzodioxol-4-yl)phenyl]benzenesulfonamide Openeye Name: 3-cyano-4-fluoro-N-[2-(5-hydroxy-1,3-benzodioxol-4-yl)phenyl]benzenesulfonamide CAS Name: 3-cyano-4-fluoro-N-[2-(5-hydroxy-1,3-benzodioxol-4-yl)phenyl]benzenesulfonamide IUPAC Name: 3-cyano-4-fluoro-N-[2-(5-hydroxy-1,3-benzodioxol-4-yl)phenyl]benzenesulfonamide Traditional Name: 3-cyano-4-fluoro-N-[2-(5-hydroxy-1,3-benzodioxol-4-yl)phenyl]benzenesulfonamide Formula: C20H13FN2O5S MolecularWeight: 412.391023

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C(=C(C=C2)O)C3=CC=CC=C3NS(=O)(=O)C4=CC(=C(C=C4)F)C#N

Isomeric SMILES

C1OC2=C(O1)C(=C(C=C2)O)C3=CC=CC=C3NS(=O)(=O)C4=CC(=C(C=C4)F)C#N

InChI

InChI=1S/C20H13FN2O5S/c21-15-6-5-13(9-12(15)10-22)29(25,26)23-16-4-2-1-3-14(16)19-17(24)7-8-18-20(19)28-11-27-18/h1-9,23-24H,11H2