2-hydroxyethyl-dimethyl-[3-(octadecanoylamino)propyl]azanium phosphate

Systemtic Name: 2-hydroxyethyl-dimethyl-[3-(octadecanoylamino)propyl]azanium phosphate Openeye Name: 2-hydroxyethyl-dimethyl-[3-(octadecanoylamino)propyl]ammonium phosphate CAS Name: 2-hydroxyethyl-dimethyl-[3-(1-oxooctadecylamino)propyl]ammonium phosphate IUPAC Name: 2-hydroxyethyl-dimethyl-[3-(octadecanoylamino)propyl]azanium phosphate Traditional Name: 2-hydroxyethyl-dimethyl-(3-stearamidopropyl)ammonium phosphate Formula: C25H53N2O6P-2 MolecularWeight: 508.671881

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CCO.[O-]P(=O)([O-])[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCCC[N+](C)(C)CCO.[O-]P(=O)([O-])[O-]

InChI

InChI=1S/C25H52N2O2.H3O4P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-25(29)26-21-19-22-27(2,3)23-24-28;1-5(2,3)4/h28H,4-24H2,1-3H3;(H3,1,2,3,4)/p-2