(2E)-2-[[4-(tert-butylsulfamoyl)phenyl]-(4-fluorophenyl)methylidene]-4-oxidanyl-butanoate

Systemtic Name: (2E)-2-[[4-(tert-butylsulfamoyl)phenyl]-(4-fluorophenyl)methylidene]-4-oxidanyl-butanoate Openeye Name: (2E)-2-[[4-(tert-butylsulfamoyl)phenyl]-(4-fluorophenyl)methylene]-4-hydroxy-butanoate CAS Name: (2E)-2-[[4-(tert-butylsulfamoyl)phenyl]-(4-fluorophenyl)methylidene]-4-hydroxybutanoate IUPAC Name: (2E)-2-[[4-(tert-butylsulfamoyl)phenyl]-(4-fluorophenyl)methylidene]-4-hydroxybutanoate Traditional Name: (E)-3-[4-(tert-butylsulfamoyl)phenyl]-3-(4-fluorophenyl)-2-(2-hydroxyethyl)acrylate Formula: C21H23FNO5S- MolecularWeight: 420.474423

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)C(=C(CCO)C(=O)[O-])C2=CC=C(C=C2)F

Isomeric SMILES

CC(C)(C)NS(=O)(=O)C1=CC=C(C=C1)/C(=C(\CCO)/C(=O)[O-])/C2=CC=C(C=C2)F

InChI

InChI=1S/C21H24FNO5S/c1-21(2,3)23-29(27,28)17-10-6-15(7-11-17)19(18(12-13-24)20(25)26)14-4-8-16(22)9-5-14/h4-11,23-24H,12-13H2,1-3H3,(H,25,26)/p-1/b19-18+