5-[[4-(carboxymethyl)phenyl]sulfamoyl]-2-oxidanyl-4-phenyldiazenyl-benzoic acid

Systemtic Name: 5-[[4-(carboxymethyl)phenyl]sulfamoyl]-2-oxidanyl-4-phenyldiazenyl-benzoic acid Openeye Name: 5-[[4-(carboxymethyl)phenyl]sulfamoyl]-2-hydroxy-4-phenylazo-benzoic acid CAS Name: 5-[[4-(carboxymethyl)phenyl]sulfamoyl]-2-hydroxy-4-phenyldiazenylbenzoic acid IUPAC Name: 5-[[4-(carboxymethyl)phenyl]sulfamoyl]-2-hydroxy-4-phenyldiazenylbenzoic acid Traditional Name: 5-[[4-(carboxymethyl)phenyl]sulfamoyl]-2-hydroxy-4-phenylazo-benzoic acid Formula: C21H17N3O7S MolecularWeight: 455.44058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N=NC2=C(C=C(C(=C2)O)C(=O)O)S(=O)(=O)NC3=CC=C(C=C3)CC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)N=NC2=C(C=C(C(=C2)O)C(=O)O)S(=O)(=O)NC3=CC=C(C=C3)CC(=O)O

InChI

InChI=1S/C21H17N3O7S/c25-18-12-17(23-22-14-4-2-1-3-5-14)19(11-16(18)21(28)29)32(30,31)24-15-8-6-13(7-9-15)10-20(26)27/h1-9,11-12,24-25H,10H2,(H,26,27)(H,28,29)