(2R)-2-[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]sulfonylpropanoic acid

Systemtic Name: (2R)-2-[2-(2-cyanoethylamino)-2-oxidanylidene-ethyl]sulfonylpropanoic acid Openeye Name: (2R)-2-[2-(2-cyanoethylamino)-2-oxo-ethyl]sulfonylpropanoic acid CAS Name: (2R)-2-[2-(2-cyanoethylamino)-2-oxoethyl]sulfonylpropanoic acid IUPAC Name: (2R)-2-[2-(2-cyanoethylamino)-2-oxoethyl]sulfonylpropanoic acid Traditional Name: (2R)-2-[2-(2-cyanoethylamino)-2-keto-ethyl]sulfonylpropionic acid Formula: C8H12N2O5S MolecularWeight: 248.25628

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)S(=O)(=O)CC(=O)NCCC#N

Isomeric SMILES

C[C@H](C(=O)O)S(=O)(=O)CC(=O)NCCC#N

InChI

InChI=1S/C8H12N2O5S/c1-6(8(12)13)16(14,15)5-7(11)10-4-2-3-9/h6H,2,4-5H2,1H3,(H,10,11)(H,12,13)/t6-/m1/s1