3-[(2,3-dimethyl-5-sulfamoyl-phenyl)sulfamoyl]propanoic acid

Systemtic Name: 3-[(2,3-dimethyl-5-sulfamoyl-phenyl)sulfamoyl]propanoic acid Openeye Name: 3-[(2,3-dimethyl-5-sulfamoyl-phenyl)sulfamoyl]propanoic acid CAS Name: 3-[(2,3-dimethyl-5-sulfamoylphenyl)sulfamoyl]propanoic acid IUPAC Name: 3-[(2,3-dimethyl-5-sulfamoylphenyl)sulfamoyl]propanoic acid Traditional Name: 3-[(2,3-dimethyl-5-sulfamoyl-phenyl)sulfamoyl]propionic acid Formula: C11H16N2O6S2 MolecularWeight: 336.38454

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1C)NS(=O)(=O)CCC(=O)O)S(=O)(=O)N

Isomeric SMILES

CC1=CC(=CC(=C1C)NS(=O)(=O)CCC(=O)O)S(=O)(=O)N

InChI

InChI=1S/C11H16N2O6S2/c1-7-5-9(21(12,18)19)6-10(8(7)2)13-20(16,17)4-3-11(14)15/h5-6,13H,3-4H2,1-2H3,(H,14,15)(H2,12,18,19)