2-(4-methyl-1,3-thiazol-3-ium-3-yl)ethanesulfonate

Systemtic Name: 2-(4-methyl-1,3-thiazol-3-ium-3-yl)ethanesulfonate Openeye Name: 2-(4-methylthiazol-3-ium-3-yl)ethanesulfonate CAS Name: 2-(4-methyl-3-thiazol-3-iumyl)ethanesulfonate IUPAC Name: 2-(4-methyl-1,3-thiazol-3-ium-3-yl)ethanesulfonate Traditional Name: 2-(4-methylthiazol-3-ium-3-yl)ethanesulfonate Formula: C6H9NO3S2 MolecularWeight: 207.27056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC=[N+]1CCS(=O)(=O)[O-]

Isomeric SMILES

CC1=CSC=[N+]1CCS(=O)(=O)[O-]

InChI

InChI=1S/C6H9NO3S2/c1-6-4-11-5-7(6)2-3-12(8,9)10/h4-5H,2-3H2,1H3