disodium N'-(2-phosphonatosulfanylethyl)propane-1,3-diamine

Systemtic Name: disodium N'-(2-phosphonatosulfanylethyl)propane-1,3-diamine Openeye Name: disodium N'-(2-phosphonatosulfanylethyl)propane-1,3-diamine CAS Name: disodium N'-[2-(phosphonatothio)ethyl]propane-1,3-diamine IUPAC Name: disodium N'-(2-phosphonatosulfanylethyl)propane-1,3-diamine Traditional Name: disodium 3-aminopropyl-[2-(phosphonatothio)ethyl]amine Formula: C5H13N2Na2O3PS MolecularWeight: 258.186621

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C(CN)CNCCSP(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

C(CN)CNCCSP(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C5H15N2O3PS.2Na/c6-2-1-3-7-4-5-12-11(8,9)10;;/h7H,1-6H2,(H2,8,9,10);;/q;2*+1/p-2