1-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)azaniumyl]propyl phosphate

Systemtic Name: 1-[(1-oxidanyl-1-oxidanylidene-3-sulfanyl-propan-2-yl)azaniumyl]propyl phosphate Openeye Name: 1-[[2-hydroxy-2-oxo-1-(sulfanylmethyl)ethyl]ammonio]propyl phosphate CAS Name: 1-[(1-hydroxy-3-mercapto-1-oxopropan-2-yl)ammonio]propyl phosphate IUPAC Name: 1-[(1-hydroxy-1-oxo-3-sulfanylpropan-2-yl)azaniumyl]propyl phosphate Traditional Name: 1-[[2-hydroxy-2-keto-1-(mercaptomethyl)ethyl]ammonio]propyl phosphate Formula: C6H13NO6PS- MolecularWeight: 258.209281

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Descriptors Computed from Structure

Canonical SMILES:

CCC([NH2+]C(CS)C(=O)O)OP(=O)([O-])[O-]

Isomeric SMILES

CCC([NH2+]C(CS)C(=O)O)OP(=O)([O-])[O-]

InChI

InChI=1S/C6H14NO6PS/c1-2-5(13-14(10,11)12)7-4(3-15)6(8)9/h4-5,7,15H,2-3H2,1H3,(H,8,9)(H2,10,11,12)/p-1