3-(2-acetyloxyethylazaniumyl)propane-1-sulfonate

Systemtic Name: 3-(2-acetyloxyethylazaniumyl)propane-1-sulfonate Openeye Name: 3-(2-acetoxyethylammonio)propane-1-sulfonate CAS Name: 3-(2-acetyloxyethylammonio)-1-propanesulfonate IUPAC Name: 3-(2-acetyloxyethylazaniumyl)propane-1-sulfonate Traditional Name: 3-(2-acetoxyethylammonio)propane-1-sulfonate Formula: C7H15NO5S MolecularWeight: 225.2627

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)OCC[NH2+]CCCS(=O)(=O)[O-]

Isomeric SMILES

CC(=O)OCC[NH2+]CCCS(=O)(=O)[O-]

InChI

InChI=1S/C7H15NO5S/c1-7(9)13-5-4-8-3-2-6-14(10,11)12/h8H,2-6H2,1H3,(H,10,11,12)