disodium 6-azanyl-1,1-diphosphonato-hexan-1-ol

Systemtic Name: disodium 6-azanyl-1,1-diphosphonato-hexan-1-ol Openeye Name: disodium 6-amino-1,1-diphosphonato-hexan-1-ol CAS Name: disodium 6-amino-1,1-diphosphonato-1-hexanol IUPAC Name: disodium 6-amino-1,1-diphosphonatohexan-1-ol Traditional Name: disodium 6-amino-1,1-diphosphonato-hexan-1-ol Formula: C6H13NNa2O7P2-2 MolecularWeight: 319.096982

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Descriptors Computed from Structure

Canonical SMILES:

C(CCC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-])CCN.[Na+].[Na+]

Isomeric SMILES

C(CCC(O)(P(=O)([O-])[O-])P(=O)([O-])[O-])CCN.[Na+].[Na+]

InChI

InChI=1S/C6H17NO7P2.2Na/c7-5-3-1-2-4-6(8,15(9,10)11)16(12,13)14;;/h8H,1-5,7H2,(H2,9,10,11)(H2,12,13,14);;/q;2*+1/p-4