2-(2-cyanoethylamino)ethylsulfanylphosphonic acid

Systemtic Name: 2-(2-cyanoethylamino)ethylsulfanylphosphonic acid Openeye Name: 2-(2-cyanoethylamino)ethylsulfanylphosphonic acid CAS Name: [2-(2-cyanoethylamino)ethylthio]phosphonic acid IUPAC Name: 2-(2-cyanoethylamino)ethylsulfanylphosphonic acid Traditional Name: [2-(2-cyanoethylamino)ethylthio]phosphonic acid Formula: C5H11N2O3PS MolecularWeight: 210.191201

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Descriptors Computed from Structure

Canonical SMILES:

C(CNCCSP(=O)(O)O)C#N

Isomeric SMILES

C(CNCCSP(=O)(O)O)C#N

InChI

InChI=1S/C5H11N2O3PS/c6-2-1-3-7-4-5-12-11(8,9)10/h7H,1,3-5H2,(H2,8,9,10)