2-(2-cyanoethanoylamino)ethanesulfonic acid

Systemtic Name: 2-(2-cyanoethanoylamino)ethanesulfonic acid Openeye Name: 2-[(2-cyanoacetyl)amino]ethanesulfonic acid CAS Name: 2-[(2-cyano-1-oxoethyl)amino]ethanesulfonic acid IUPAC Name: 2-[(2-cyanoacetyl)amino]ethanesulfonic acid Traditional Name: 2-[(2-cyanoacetyl)amino]ethanesulfonic acid Formula: C5H8N2O4S MolecularWeight: 192.19302

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C5H8N2O4S/c6-2-1-5(8)7-3-4-12(9,10)11/h1,3-4H2,(H,7,8)(H,9,10,11)