diethyl-(2-hydroxyethyl)-[2-(octadecanoylamino)ethyl]azanium; ethyl sulfate

Systemtic Name: diethyl-(2-hydroxyethyl)-[2-(octadecanoylamino)ethyl]azanium; ethyl sulfate Openeye Name: diethyl-(2-hydroxyethyl)-[2-(octadecanoylamino)ethyl]ammonium; ethyl sulfate CAS Name: diethyl-(2-hydroxyethyl)-[2-(1-oxooctadecylamino)ethyl]ammonium; ethyl sulfate IUPAC Name: diethyl-(2-hydroxyethyl)-[2-(octadecanoylamino)ethyl]azanium; ethyl sulfate Traditional Name: diethyl-(2-hydroxyethyl)-(2-stearamidoethyl)ammonium; ethyl sulfate Formula: C28H60N2O6S MolecularWeight: 552.8508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CC)CCO.CCOS(=O)(=O)[O-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)NCC[N+](CC)(CC)CCO.CCOS(=O)(=O)[O-]

InChI

InChI=1S/C26H54N2O2.C2H6O4S/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-26(30)27-22-23-28(5-2,6-3)24-25-29;1-2-6-7(3,4)5/h29H,4-25H2,1-3H3;2H2,1H3,(H,3,4,5)