sodium 4-[[2-(methylsulfonylamino)phenyl]sulfonylamino]butane-1-sulfonate

Systemtic Name: sodium 4-[[2-(methylsulfonylamino)phenyl]sulfonylamino]butane-1-sulfonate Openeye Name: sodium 4-[[2-(methanesulfonamido)phenyl]sulfonylamino]butane-1-sulfonate CAS Name: sodium 4-[[2-(methanesulfonamido)phenyl]sulfonylamino]-1-butanesulfonate IUPAC Name: sodium 4-[[2-(methanesulfonamido)phenyl]sulfonylamino]butane-1-sulfonate Traditional Name: sodium 4-[[2-(methanesulfonamido)phenyl]sulfonylamino]butane-1-sulfonate Formula: C11H17N2NaO7S3 MolecularWeight: 408.44665

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)NC1=CC=CC=C1S(=O)(=O)NCCCCS(=O)(=O)[O-].[Na+]

Isomeric SMILES

CS(=O)(=O)NC1=CC=CC=C1S(=O)(=O)NCCCCS(=O)(=O)[O-].[Na+]

InChI

InChI=1S/C11H18N2O7S3.Na/c1-21(14,15)13-10-6-2-3-7-11(10)23(19,20)12-8-4-5-9-22(16,17)18;/h2-3,6-7,12-13H,4-5,8-9H2,1H3,(H,16,17,18);/q;+1/p-1