disodium [2-phenyl-2-(4-propoxybutanoylamino)ethyl] phosphate

Systemtic Name: disodium [2-phenyl-2-(4-propoxybutanoylamino)ethyl] phosphate Openeye Name: disodium [2-phenyl-2-(4-propoxybutanoylamino)ethyl] phosphate CAS Name: disodium [2-[(1-oxo-4-propoxybutyl)amino]-2-phenylethyl] phosphate IUPAC Name: disodium [2-phenyl-2-(4-propoxybutanoylamino)ethyl] phosphate Traditional Name: disodium [2-phenyl-2-(4-propoxybutanoylamino)ethyl] phosphate Formula: C15H22NNa2O6P MolecularWeight: 389.291581

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H24NO6P.2Na/c1-2-10-21-11-6-9-15(17)16-14(12-22-23(18,19)20)13-7-4-3-5-8-13;;/h3-5,7-8,14H,2,6,9-12H2,1H3,(H,16,17)(H2,18,19,20);;/q;2*+1/p-2