4-[[1,1-bis(oxidanylidene)thian-4-yl]sulfamoyl]benzoic acid

Systemtic Name: 4-[[1,1-bis(oxidanylidene)thian-4-yl]sulfamoyl]benzoic acid Openeye Name: 4-[(1,1-dioxothian-4-yl)sulfamoyl]benzoic acid CAS Name: 4-[(1,1-dioxo-4-thianyl)sulfamoyl]benzoic acid IUPAC Name: 4-[(1,1-dioxothian-4-yl)sulfamoyl]benzoic acid Traditional Name: 4-[(1,1-diketothian-4-yl)sulfamoyl]benzoic acid Formula: C12H15NO6S2 MolecularWeight: 333.3806

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CCC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)O

Isomeric SMILES

C1CS(=O)(=O)CCC1NS(=O)(=O)C2=CC=C(C=C2)C(=O)O

InChI

InChI=1S/C12H15NO6S2/c14-12(15)9-1-3-11(4-2-9)21(18,19)13-10-5-7-20(16,17)8-6-10/h1-4,10,13H,5-8H2,(H,14,15)