phenyl 1-sulfamoylpropane-1-sulfonate

Systemtic Name: phenyl 1-sulfamoylpropane-1-sulfonate Openeye Name: phenyl 1-sulfamoylpropane-1-sulfonate CAS Name: 1-sulfamoyl-1-propanesulfonic acid IUPAC Name: phenyl 1-sulfamoylpropane-1-sulfonate Traditional Name: 1-sulfamoylpropane-1-sulfonic acid phenyl ester Formula: C9H13NO5S2 MolecularWeight: 279.33322

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Descriptors Computed from Structure

Canonical SMILES:

CCC(S(=O)(=O)N)S(=O)(=O)OC1=CC=CC=C1

Isomeric SMILES

CCC(S(=O)(=O)N)S(=O)(=O)OC1=CC=CC=C1

InChI

InChI=1S/C9H13NO5S2/c1-2-9(16(10,11)12)17(13,14)15-8-6-4-3-5-7-8/h3-7,9H,2H2,1H3,(H2,10,11,12)