dimethyl-bis[2-(3-octadecoxypropanoyloxy)ethyl]azanium chloride

Systemtic Name: dimethyl-bis[2-(3-octadecoxypropanoyloxy)ethyl]azanium chloride Openeye Name: dimethyl-bis[2-(3-octadecoxypropanoyloxy)ethyl]ammonium chloride CAS Name: dimethyl-bis[2-(3-octadecoxy-1-oxopropoxy)ethyl]ammonium chloride IUPAC Name: dimethyl-bis[2-(3-octadecoxypropanoyloxy)ethyl]azanium chloride Traditional Name: dimethyl-bis[2-(3-stearyloxypropanoyloxy)ethyl]ammonium chloride Formula: C48H96ClNO6 MolecularWeight: 818.73194

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCCC(=O)OCC[N+](C)(C)CCOC(=O)CCOCCCCCCCCCCCCCCCCCC.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCCC(=O)OCC[N+](C)(C)CCOC(=O)CCOCCCCCCCCCCCCCCCCCC.[Cl-]

InChI

InChI=1S/C48H96NO6.ClH/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-41-52-43-37-47(50)54-45-39-49(3,4)40-46-55-48(51)38-44-53-42-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2;/h5-46H2,1-4H3;1H/q+1;/p-1