phosphono 2-cyanoethanesulfonate

Systemtic Name: phosphono 2-cyanoethanesulfonate Openeye Name: phosphono 2-cyanoethanesulfonate CAS Name: 2-cyanoethanesulfonic acid phosphono ester IUPAC Name: phosphono 2-cyanoethanesulfonate Traditional Name: 2-cyanoethanesulfonic acid phosphono ester Formula: C3H6NO6PS MolecularWeight: 215.121601

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Descriptors Computed from Structure

Canonical SMILES:

C(CS(=O)(=O)OP(=O)(O)O)C#N

Isomeric SMILES

C(CS(=O)(=O)OP(=O)(O)O)C#N

InChI

InChI=1S/C3H6NO6PS/c4-2-1-3-12(8,9)10-11(5,6)7/h1,3H2,(H2,5,6,7)