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

Systemtic Name: butoxymethyl-(2-hydroxyethyl)-dimethyl-azanium; 6-methyl-2,2-bis(oxidanylidene)-1,2,3-oxathiazin-4-olate Openeye Name: butoxymethyl-(2-hydroxyethyl)-dimethyl-ammonium; 6-methyl-2,2-dioxo-oxathiazin-4-olate CAS Name: butoxymethyl-(2-hydroxyethyl)-dimethylammonium; 6-methyl-2,2-dioxo-4-oxathiazinolate IUPAC Name: butoxymethyl-(2-hydroxyethyl)-dimethylazanium; 6-methyl-2,2-dioxooxathiazin-4-olate Traditional Name: butoxymethyl-(2-hydroxyethyl)-dimethyl-ammonium; 2,2-diketo-6-methyl-oxathiazin-4-olate Formula: C13H26N2O6S MolecularWeight: 338.42034

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C9H22NO2.C4H5NO4S/c1-4-5-8-12-9-10(2,3)6-7-11;1-3-2-4(6)5-10(7,8)9-3/h11H,4-9H2,1-3H3;2H,1H3,(H,5,6)/q+1;/p-1