1-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]iminoethanesulfonic acid

Systemtic Name: 1-[2-(hydroxymethyl)-1,3-bis(oxidanyl)propan-2-yl]iminoethanesulfonic acid Openeye Name: 1-[2-hydroxy-1,1-bis(hydroxymethyl)ethyl]iminoethanesulfonic acid CAS Name: 1-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]iminoethanesulfonic acid IUPAC Name: 1-[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]iminoethanesulfonic acid Traditional Name: 1-(2-hydroxy-1,1-dimethylol-ethyl)iminoethanesulfonic acid Formula: C6H13NO6S MolecularWeight: 227.23552

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=NC(CO)(CO)CO)S(=O)(=O)O

Isomeric SMILES

CC(=NC(CO)(CO)CO)S(=O)(=O)O

InChI

InChI=1S/C6H13NO6S/c1-5(14(11,12)13)7-6(2-8,3-9)4-10/h8-10H,2-4H2,1H3,(H,11,12,13)