5-[[2-(butan-2-ylcarbamoyl)phenyl]sulfamoyl]-2-fluoranyl-benzoic acid

Systemtic Name: 5-[[2-(butan-2-ylcarbamoyl)phenyl]sulfamoyl]-2-fluoranyl-benzoic acid Openeye Name: 2-fluoro-5-[[2-(sec-butylcarbamoyl)phenyl]sulfamoyl]benzoic acid CAS Name: 5-[[2-[(butan-2-ylamino)-oxomethyl]phenyl]sulfamoyl]-2-fluorobenzoic acid IUPAC Name: 5-[[2-(butan-2-ylcarbamoyl)phenyl]sulfamoyl]-2-fluorobenzoic acid Traditional Name: 2-fluoro-5-[[2-(sec-butylcarbamoyl)phenyl]sulfamoyl]benzoic acid Formula: C18H19FN2O5S MolecularWeight: 394.417263

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)O

Isomeric SMILES

CCC(C)NC(=O)C1=CC=CC=C1NS(=O)(=O)C2=CC(=C(C=C2)F)C(=O)O

InChI

InChI=1S/C18H19FN2O5S/c1-3-11(2)20-17(22)13-6-4-5-7-16(13)21-27(25,26)12-8-9-15(19)14(10-12)18(23)24/h4-11,21H,3H2,1-2H3,(H,20,22)(H,23,24)