2-(2-isocyanoethanoylamino)ethanesulfonic acid

Systemtic Name: 2-(2-isocyanoethanoylamino)ethanesulfonic acid Openeye Name: 2-[(2-isocyanoacetyl)amino]ethanesulfonic acid CAS Name: 2-[(2-isocyano-1-oxoethyl)amino]ethanesulfonic acid IUPAC Name: 2-[(2-isocyanoacetyl)amino]ethanesulfonic acid Traditional Name: 2-[(2-isocyanoacetyl)amino]ethanesulfonic acid Formula: C5H8N2O4S MolecularWeight: 192.19302

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Descriptors Computed from Structure

Canonical SMILES:

[C-]#[N+]CC(=O)NCCS(=O)(=O)O

Isomeric SMILES

[C-]#[N+]CC(=O)NCCS(=O)(=O)O

InChI

InChI=1S/C5H8N2O4S/c1-6-4-5(8)7-2-3-12(9,10)11/h2-4H2,(H,7,8)(H,9,10,11)