4-fluoranyl-3-[2-[4-(2-methylbutan-2-yl)phenoxy]ethylsulfamoyl]benzoic acid

Systemtic Name: 4-fluoranyl-3-[2-[4-(2-methylbutan-2-yl)phenoxy]ethylsulfamoyl]benzoic acid Openeye Name: 3-[2-[4-(1,1-dimethylpropyl)phenoxy]ethylsulfamoyl]-4-fluoro-benzoic acid CAS Name: 4-fluoro-3-[2-[4-(2-methylbutan-2-yl)phenoxy]ethylsulfamoyl]benzoic acid IUPAC Name: 4-fluoro-3-[2-[4-(2-methylbutan-2-yl)phenoxy]ethylsulfamoyl]benzoic acid Traditional Name: 3-[2-(4-tert-amylphenoxy)ethylsulfamoyl]-4-fluoro-benzoic acid Formula: C20H24FNO5S MolecularWeight: 409.471663

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC=C(C=C1)OCCNS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)F

Isomeric SMILES

CCC(C)(C)C1=CC=C(C=C1)OCCNS(=O)(=O)C2=C(C=CC(=C2)C(=O)O)F

InChI

InChI=1S/C20H24FNO5S/c1-4-20(2,3)15-6-8-16(9-7-15)27-12-11-22-28(25,26)18-13-14(19(23)24)5-10-17(18)21/h5-10,13,22H,4,11-12H2,1-3H3,(H,23,24)