disodium 3-[2-ethylhexyl-(3-oxidanidyl-3-oxidanylidene-propyl)amino]propanoate

Systemtic Name: disodium 3-[2-ethylhexyl-(3-oxidanidyl-3-oxidanylidene-propyl)amino]propanoate Openeye Name: disodium 3-[2-ethylhexyl-(3-oxido-3-oxo-propyl)amino]propanoate CAS Name: disodium 3-[2-ethylhexyl-(3-oxido-3-oxopropyl)amino]propanoate IUPAC Name: disodium 3-[2-ethylhexyl-(3-oxido-3-oxopropyl)amino]propanoate Traditional Name: disodium 3-[2-ethylhexyl-(3-keto-3-oxido-propyl)amino]propionate Formula: C14H25NNa2O4 MolecularWeight: 317.33214

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CC)CN(CCC(=O)[O-])CCC(=O)[O-].[Na+].[Na+]

Isomeric SMILES

CCCCC(CC)CN(CCC(=O)[O-])CCC(=O)[O-].[Na+].[Na+]

InChI

InChI=1S/C14H27NO4.2Na/c1-3-5-6-12(4-2)11-15(9-7-13(16)17)10-8-14(18)19;;/h12H,3-11H2,1-2H3,(H,16,17)(H,18,19);;/q;2*+1/p-2