tetrasodium N-(2,2-dimethyl-1-phosphonato-propyl)-2-phosphonato-ethanamide

Systemtic Name: tetrasodium N-(2,2-dimethyl-1-phosphonato-propyl)-2-phosphonato-ethanamide Openeye Name: tetrasodium N-(2,2-dimethyl-1-phosphonato-propyl)-2-phosphonato-acetamide CAS Name: tetrasodium N-(2,2-dimethyl-1-phosphonatopropyl)-2-phosphonatoacetamide IUPAC Name: tetrasodium N-(2,2-dimethyl-1-phosphonatopropyl)-2-phosphonatoacetamide Traditional Name: tetrasodium N-(2,2-dimethyl-1-phosphonato-propyl)-2-phosphonato-acetamide Formula: C7H13NNa4O7P2 MolecularWeight: 377.087222

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(NC(=O)CP(=O)([O-])[O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]

Isomeric SMILES

CC(C)(C)C(NC(=O)CP(=O)([O-])[O-])P(=O)([O-])[O-].[Na+].[Na+].[Na+].[Na+]

InChI

InChI=1S/C7H17NO7P2.4Na/c1-7(2,3)6(17(13,14)15)8-5(9)4-16(10,11)12;;;;/h6H,4H2,1-3H3,(H,8,9)(H2,10,11,12)(H2,13,14,15);;;;/q;4*+1/p-4