sodium 3-[butyl(diethoxyphosphorylmethyl)amino]propanoate

Systemtic Name: sodium 3-[butyl(diethoxyphosphorylmethyl)amino]propanoate Openeye Name: sodium 3-[butyl(diethoxyphosphorylmethyl)amino]propanoate CAS Name: sodium 3-[butyl(diethoxyphosphorylmethyl)amino]propanoate IUPAC Name: sodium 3-[butyl(diethoxyphosphorylmethyl)amino]propanoate Traditional Name: sodium 3-[butyl(diethoxyphosphorylmethyl)amino]propionate Formula: C12H25NNaO5P MolecularWeight: 317.294131

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H26NO5P.Na/c1-4-7-9-13(10-8-12(14)15)11-19(16,17-5-2)18-6-3;/h4-11H2,1-3H3,(H,14,15);/q;+1/p-1