disodium [2-[3-(2-methoxyethoxy)phenyl]-2-(octanoylamino)ethyl] phosphate

Systemtic Name: disodium [2-[3-(2-methoxyethoxy)phenyl]-2-(octanoylamino)ethyl] phosphate Openeye Name: disodium [2-[3-(2-methoxyethoxy)phenyl]-2-(octanoylamino)ethyl] phosphate CAS Name: disodium [2-[3-(2-methoxyethoxy)phenyl]-2-(1-oxooctylamino)ethyl] phosphate IUPAC Name: disodium [2-[3-(2-methoxyethoxy)phenyl]-2-(octanoylamino)ethyl] phosphate Traditional Name: disodium [2-(caprylylamino)-2-[3-(2-methoxyethoxy)phenyl]ethyl] phosphate Formula: C19H30NNa2O7P MolecularWeight: 461.397301

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H32NO7P.2Na/c1-3-4-5-6-7-11-19(21)20-18(15-27-28(22,23)24)16-9-8-10-17(14-16)26-13-12-25-2;;/h8-10,14,18H,3-7,11-13,15H2,1-2H3,(H,20,21)(H2,22,23,24);;/q;2*+1/p-2