2-hydroxyethyl-dimethyl-(propoxymethyl)azanium; 6-methyl-2,2-bis(oxidanylidene)-1,2,3-oxathiazin-4-olate

Systemtic Name: 2-hydroxyethyl-dimethyl-(propoxymethyl)azanium; 6-methyl-2,2-bis(oxidanylidene)-1,2,3-oxathiazin-4-olate Openeye Name: 2-hydroxyethyl-dimethyl-(propoxymethyl)ammonium; 6-methyl-2,2-dioxo-oxathiazin-4-olate CAS Name: 2-hydroxyethyl-dimethyl-(propoxymethyl)ammonium; 6-methyl-2,2-dioxo-4-oxathiazinolate IUPAC Name: 2-hydroxyethyl-dimethyl-(propoxymethyl)azanium; 6-methyl-2,2-dioxooxathiazin-4-olate Traditional Name: 2,2-diketo-6-methyl-oxathiazin-4-olate; 2-hydroxyethyl-dimethyl-(propoxymethyl)ammonium Formula: C12H24N2O6S MolecularWeight: 324.39376

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC[N+](C)(C)CCO.CC1=CC(=NS(=O)(=O)O1)[O-]

Isomeric SMILES

CCCOC[N+](C)(C)CCO.CC1=CC(=NS(=O)(=O)O1)[O-]

InChI

InChI=1S/C8H20NO2.C4H5NO4S/c1-4-7-11-8-9(2,3)5-6-10;1-3-2-4(6)5-10(7,8)9-3/h10H,4-8H2,1-3H3;2H,1H3,(H,5,6)/q+1;/p-1