tetrasodium N-(2-methyl-1-phosphonato-propyl)-2-phosphonato-ethanamide

Systemtic Name: tetrasodium N-(2-methyl-1-phosphonato-propyl)-2-phosphonato-ethanamide Openeye Name: tetrasodium N-(2-methyl-1-phosphonato-propyl)-2-phosphonato-acetamide CAS Name: tetrasodium N-(2-methyl-1-phosphonatopropyl)-2-phosphonatoacetamide IUPAC Name: tetrasodium N-(2-methyl-1-phosphonatopropyl)-2-phosphonatoacetamide Traditional Name: tetrasodium N-(2-methyl-1-phosphonato-propyl)-2-phosphonato-acetamide Formula: C6H11NNa4O7P2 MolecularWeight: 363.060642

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C6H15NO7P2.4Na/c1-4(2)6(16(12,13)14)7-5(8)3-15(9,10)11;;;;/h4,6H,3H2,1-2H3,(H,7,8)(H2,9,10,11)(H2,12,13,14);;;;/q;4*+1/p-4