3-(butylamino)-5-sulfamoyl-4-(4-sulfamoylphenoxy)benzoic acid

Systemtic Name: 3-(butylamino)-5-sulfamoyl-4-(4-sulfamoylphenoxy)benzoic acid Openeye Name: 3-(butylamino)-5-sulfamoyl-4-(4-sulfamoylphenoxy)benzoic acid CAS Name: 3-(butylamino)-5-sulfamoyl-4-(4-sulfamoylphenoxy)benzoic acid IUPAC Name: 3-(butylamino)-5-sulfamoyl-4-(4-sulfamoylphenoxy)benzoic acid Traditional Name: 3-(butylamino)-5-sulfamoyl-4-(4-sulfamoylphenoxy)benzoic acid Formula: C17H21N3O7S2 MolecularWeight: 443.49454

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=C(C=C2)S(=O)(=O)N

Isomeric SMILES

CCCCNC1=C(C(=CC(=C1)C(=O)O)S(=O)(=O)N)OC2=CC=C(C=C2)S(=O)(=O)N

InChI

InChI=1S/C17H21N3O7S2/c1-2-3-8-20-14-9-11(17(21)22)10-15(29(19,25)26)16(14)27-12-4-6-13(7-5-12)28(18,23)24/h4-7,9-10,20H,2-3,8H2,1H3,(H,21,22)(H2,18,23,24)(H2,19,25,26)