[4-[4-(butan-2-ylsulfamoyl)phenoxy]sulfonylphenyl] 4-oxidanylbenzenesulfonate

Systemtic Name: [4-[4-(butan-2-ylsulfamoyl)phenoxy]sulfonylphenyl] 4-oxidanylbenzenesulfonate Openeye Name: [4-[4-(sec-butylsulfamoyl)phenoxy]sulfonylphenyl] 4-hydroxybenzenesulfonate CAS Name: 4-hydroxybenzenesulfonic acid [4-[4-(butan-2-ylsulfamoyl)phenoxy]sulfonylphenyl] ester IUPAC Name: [4-[4-(butan-2-ylsulfamoyl)phenoxy]sulfonylphenyl] 4-hydroxybenzenesulfonate Traditional Name: 4-hydroxybenzenesulfonic acid [4-[4-(sec-butylsulfamoyl)phenoxy]sulfonylphenyl] ester Formula: C22H23NO9S3 MolecularWeight: 541.61432

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)O

Isomeric SMILES

CCC(C)NS(=O)(=O)C1=CC=C(C=C1)OS(=O)(=O)C2=CC=C(C=C2)OS(=O)(=O)C3=CC=C(C=C3)O

InChI

InChI=1S/C22H23NO9S3/c1-3-16(2)23-33(25,26)20-12-6-18(7-13-20)31-35(29,30)22-14-8-19(9-15-22)32-34(27,28)21-10-4-17(24)5-11-21/h4-16,23-24H,3H2,1-2H3