3-cyano-1-diethoxyphosphoryl-propane-1-sulfonic acid

Systemtic Name: 3-cyano-1-diethoxyphosphoryl-propane-1-sulfonic acid Openeye Name: 3-cyano-1-diethoxyphosphoryl-propane-1-sulfonic acid CAS Name: 3-cyano-1-diethoxyphosphoryl-1-propanesulfonic acid IUPAC Name: 3-cyano-1-diethoxyphosphorylpropane-1-sulfonic acid Traditional Name: 3-cyano-1-diethoxyphosphoryl-propane-1-sulfonic acid Formula: C8H16NO6PS MolecularWeight: 285.254501

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Descriptors Computed from Structure

Canonical SMILES:

CCOP(=O)(C(CCC#N)S(=O)(=O)O)OCC

Isomeric SMILES

CCOP(=O)(C(CCC#N)S(=O)(=O)O)OCC

InChI

InChI=1S/C8H16NO6PS/c1-3-14-16(10,15-4-2)8(6-5-7-9)17(11,12)13/h8H,3-6H2,1-2H3,(H,11,12,13)