3-[2-(cyanomethylamino)-2-oxidanylidene-ethyl]sulfonylpropanoic acid

Systemtic Name: 3-[2-(cyanomethylamino)-2-oxidanylidene-ethyl]sulfonylpropanoic acid Openeye Name: 3-[2-(cyanomethylamino)-2-oxo-ethyl]sulfonylpropanoic acid CAS Name: 3-[2-(cyanomethylamino)-2-oxoethyl]sulfonylpropanoic acid IUPAC Name: 3-[2-(cyanomethylamino)-2-oxoethyl]sulfonylpropanoic acid Traditional Name: 3-[2-(cyanomethylamino)-2-keto-ethyl]sulfonylpropionic acid Formula: C7H10N2O5S MolecularWeight: 234.2297

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CS(=O)(=O)CC(=O)NCC#N)C(=O)O

Isomeric SMILES

C(CS(=O)(=O)CC(=O)NCC#N)C(=O)O

InChI

InChI=1S/C7H10N2O5S/c8-2-3-9-6(10)5-15(13,14)4-1-7(11)12/h1,3-5H2,(H,9,10)(H,11,12)