4-[2-(6-bromanyl-1-oxidanyl-3-oxidanylidene-1-phenyl-isoindol-2-yl)ethyl]benzenesulfonamide

Systemtic Name: 4-[2-(6-bromanyl-1-oxidanyl-3-oxidanylidene-1-phenyl-isoindol-2-yl)ethyl]benzenesulfonamide Openeye Name: 4-[2-(6-bromo-1-hydroxy-3-oxo-1-phenyl-isoindolin-2-yl)ethyl]benzenesulfonamide CAS Name: 4-[2-(6-bromo-1-hydroxy-3-oxo-1-phenyl-2-isoindolyl)ethyl]benzenesulfonamide IUPAC Name: 4-[2-(6-bromo-1-hydroxy-3-oxo-1-phenylisoindol-2-yl)ethyl]benzenesulfonamide Traditional Name: 4-[2-(6-bromo-1-hydroxy-3-keto-1-phenyl-isoindolin-2-yl)ethyl]benzenesulfonamide Formula: C22H19BrN2O4S MolecularWeight: 487.36626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2(C3=C(C=CC(=C3)Br)C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N)O

Isomeric SMILES

C1=CC=C(C=C1)C2(C3=C(C=CC(=C3)Br)C(=O)N2CCC4=CC=C(C=C4)S(=O)(=O)N)O

InChI

InChI=1S/C22H19BrN2O4S/c23-17-8-11-19-20(14-17)22(27,16-4-2-1-3-5-16)25(21(19)26)13-12-15-6-9-18(10-7-15)30(24,28)29/h1-11,14,27H,12-13H2,(H2,24,28,29)