3-[[3-(dibutylsulfamoyl)phenyl]carbonylamino]benzoic acid

Systemtic Name: 3-[[3-(dibutylsulfamoyl)phenyl]carbonylamino]benzoic acid Openeye Name: 3-[[3-(dibutylsulfamoyl)benzoyl]amino]benzoic acid CAS Name: 3-[[[3-(dibutylsulfamoyl)phenyl]-oxomethyl]amino]benzoic acid IUPAC Name: 3-[[3-(dibutylsulfamoyl)benzoyl]amino]benzoic acid Traditional Name: 3-[[3-(dibutylsulfamoyl)benzoyl]amino]benzoic acid Formula: C22H28N2O5S MolecularWeight: 432.53312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCCCN(CCCC)S(=O)(=O)C1=CC=CC(=C1)C(=O)NC2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C22H28N2O5S/c1-3-5-13-24(14-6-4-2)30(28,29)20-12-8-9-17(16-20)21(25)23-19-11-7-10-18(15-19)22(26)27/h7-12,15-16H,3-6,13-14H2,1-2H3,(H,23,25)(H,26,27)