triazanium 3-methylbut-2-enylsulfanyl(phosphonatooxy)phosphinate

Systemtic Name: triazanium 3-methylbut-2-enylsulfanyl(phosphonatooxy)phosphinate Openeye Name: triammonium 3-methylbut-2-enylsulfanyl(phosphonatooxy)phosphinate CAS Name: triammonium (3-methylbut-2-enylthio)-phosphonatooxyphosphinate IUPAC Name: triazanium 3-methylbut-2-enylsulfanyl(phosphonatooxy)phosphinate Traditional Name: triammonium (3-methylbut-2-enylthio)-phosphato-phosphinate Formula: C5H21N3O6P2S MolecularWeight: 313.249262

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCSP(=O)([O-])OP(=O)([O-])[O-])C.[NH4+].[NH4+].[NH4+]

Isomeric SMILES

CC(=CCSP(=O)([O-])OP(=O)([O-])[O-])C.[NH4+].[NH4+].[NH4+]

InChI

InChI=1S/C5H12O6P2S.3H3N/c1-5(2)3-4-14-13(9,10)11-12(6,7)8;;;/h3H,4H2,1-2H3,(H,9,10)(H2,6,7,8);3*1H3