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disodium [2-(decanoylamino)-2-phenyl-ethyl] phosphate

disodium [2-(decanoylamino)-2-phenyl-ethyl] phosphate

Systemtic Name:disodium [2-(decanoylamino)-2-phenyl-ethyl] phosphate
Openeye Name:disodium [2-(decanoylamino)-2-phenyl-ethyl] phosphate
CAS Name:disodium [2-(1-oxodecylamino)-2-phenylethyl] phosphate
IUPAC Name:disodium [2-(decanoylamino)-2-phenylethyl] phosphate
Traditional Name:disodium [2-(caprylamino)-2-phenyl-ethyl] phosphate
Formula: C18H28NNa2O5P
MolecularWeight: 415.371921
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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(=O)NC(COP(=O)([O-])[O-])C1=CC=CC=C1.[Na+].[Na+]


Isomeric SMILES

CCCCCCCCCC(=O)NC(COP(=O)([O-])[O-])C1=CC=CC=C1.[Na+].[Na+]


InChI

InChI=1S/C18H30NO5P.2Na/c1-2-3-4-5-6-7-11-14-18(20)19-17(15-24-25(21,22)23)16-12-9-8-10-13-16;;/h8-10,12-13,17H,2-7,11,14-15H2,1H3,(H,19,20)(H2,21,22,23);;/q;2*+1/p-2


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