| 2D Structure | |
| CID | 22879 |
| IUPAC Name | calcium;1,1-dioxo-1,2-benzothiazol-3-olate;hydrate |
| InChI | InChI=1S/2C7H5NO3S.Ca.H2O/c2*9-7-5-3-1-2-4-6(5)12(10,11)8-7;;/h2*1-4H,(H,8,9);;1H2/q;;+2;/p-2 |
| InChI Key | MQRKKLAGBPVXCD-UHFFFAOYSA-L |
| Canonical SMILES | None |
| Isomeric SMILES | None |
| Molecular Formula | C14H10CaN2O7S2 |
| Molecular Weight | 422.5 |
| synonyms | ['Calcium saccharin hydrate', 'DTXSID5047459', 'DTXCID3027459', '6381-91-5', 'RefChem:200050', '1,2-Benzisothiazol-3(2H)-one, 1,1-dioxide, calcium salt, hydrate (4:7)', 'C14H10CaN2O7S2', 'CHEMBL2107153', 'XOCXGVIOTKFUSU-UHFFFAOYSA-L', 'Tox21_302447', 'NCGC00256888-01', 'CAS-6381-91-5', 'NS00129378', 'calcium;1,1-dioxo-1,2-benzothiazol-3-olate;hydrate'] |
From Pubchem