3-[[4-(butylcarbamoylsulfamoyl)phenyl]sulfamoyl]benzoic acid

Systemtic Name: 3-[[4-(butylcarbamoylsulfamoyl)phenyl]sulfamoyl]benzoic acid Openeye Name: 3-[[4-(butylcarbamoylsulfamoyl)phenyl]sulfamoyl]benzoic acid CAS Name: 3-[[4-[[butylamino(oxo)methyl]sulfamoyl]phenyl]sulfamoyl]benzoic acid IUPAC Name: 3-[[4-(butylcarbamoylsulfamoyl)phenyl]sulfamoyl]benzoic acid Traditional Name: 3-[[4-(butylcarbamoylsulfamoyl)phenyl]sulfamoyl]benzoic acid Formula: C18H21N3O7S2 MolecularWeight: 455.50524

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCCCNC(=O)NS(=O)(=O)C1=CC=C(C=C1)NS(=O)(=O)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C18H21N3O7S2/c1-2-3-11-19-18(24)21-29(25,26)15-9-7-14(8-10-15)20-30(27,28)16-6-4-5-13(12-16)17(22)23/h4-10,12,20H,2-3,11H2,1H3,(H,22,23)(H2,19,21,24)