5-[[4-(methylsulfonylamino)phenyl]sulfonylamino]benzene-1,3-disulfonic acid

Systemtic Name: 5-[[4-(methylsulfonylamino)phenyl]sulfonylamino]benzene-1,3-disulfonic acid Openeye Name: 5-[[4-(methanesulfonamido)phenyl]sulfonylamino]benzene-1,3-disulfonic acid CAS Name: 5-[[4-(methanesulfonamido)phenyl]sulfonylamino]benzene-1,3-disulfonic acid IUPAC Name: 5-[[4-(methanesulfonamido)phenyl]sulfonylamino]benzene-1,3-disulfonic acid Traditional Name: 5-[[4-(methanesulfonamido)phenyl]sulfonylamino]benzene-1,3-disulfonic acid Formula: C13H14N2O10S4 MolecularWeight: 486.51766

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC(=C2)S(=O)(=O)O)S(=O)(=O)O

Isomeric SMILES

CS(=O)(=O)NC1=CC=C(C=C1)S(=O)(=O)NC2=CC(=CC(=C2)S(=O)(=O)O)S(=O)(=O)O

InChI

InChI=1S/C13H14N2O10S4/c1-26(16,17)14-9-2-4-11(5-3-9)27(18,19)15-10-6-12(28(20,21)22)8-13(7-10)29(23,24)25/h2-8,14-15H,1H3,(H,20,21,22)(H,23,24,25)