disodium N-(diphosphonatomethyl)-1,3-oxazol-2-amine

Systemtic Name: disodium N-(diphosphonatomethyl)-1,3-oxazol-2-amine Openeye Name: disodium N-(diphosphonatomethyl)oxazol-2-amine CAS Name: disodium N-(diphosphonatomethyl)-2-oxazolamine IUPAC Name: disodium N-(diphosphonatomethyl)-1,3-oxazol-2-amine Traditional Name: disodium diphosphonatomethyl(oxazol-2-yl)amine Formula: C4H4N2Na2O7P2-2 MolecularWeight: 300.010822

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=COC(=N1)NC(P(=O)([O-])[O-])P(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

C1=COC(=N1)NC(P(=O)([O-])[O-])P(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C4H8N2O7P2.2Na/c7-14(8,9)4(15(10,11)12)6-3-5-1-2-13-3;;/h1-2,4H,(H,5,6)(H2,7,8,9)(H2,10,11,12);;/q;2*+1/p-4