disodium [butyl(phosphonatomethyl)amino]methylphosphonic acid

Systemtic Name: disodium [butyl(phosphonatomethyl)amino]methylphosphonic acid Openeye Name: disodium [butyl(phosphonatomethyl)amino]methylphosphonic acid CAS Name: disodium [butyl(phosphonatomethyl)amino]methylphosphonic acid IUPAC Name: disodium [butyl(phosphonatomethyl)amino]methylphosphonic acid Traditional Name: disodium [butyl(phosphonatomethyl)amino]methylphosphonic acid Formula: C6H15NNa2O6P2 MolecularWeight: 305.113462

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CP(=O)(O)O)CP(=O)([O-])[O-].[Na+].[Na+]

Isomeric SMILES

CCCCN(CP(=O)(O)O)CP(=O)([O-])[O-].[Na+].[Na+]

InChI

InChI=1S/C6H17NO6P2.2Na/c1-2-3-4-7(5-14(8,9)10)6-15(11,12)13;;/h2-6H2,1H3,(H2,8,9,10)(H2,11,12,13);;/q;2*+1/p-2