calcium 6-methyl-2,2-bis(oxidanylidene)-1,2,3-oxathiazin-4-one

Systemtic Name: calcium 6-methyl-2,2-bis(oxidanylidene)-1,2,3-oxathiazin-4-one Openeye Name: calcium 6-methyl-2,2-dioxo-oxathiazin-4-one CAS Name: calcium 6-methyl-2,2-dioxo-4-oxathiazinone IUPAC Name: calcium 6-methyl-2,2-dioxooxathiazin-4-one Traditional Name: calcium 2,2-diketo-6-methyl-oxathiazin-4-one Formula: C4H5CaNO4S+2 MolecularWeight: 203.2298

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)NS(=O)(=O)O1.[Ca+2]

Isomeric SMILES

CC1=CC(=O)NS(=O)(=O)O1.[Ca+2]

InChI

InChI=1S/C4H5NO4S.Ca/c1-3-2-4(6)5-10(7,8)9-3;/h2H,1H3,(H,5,6);/q;+2