[2-ethoxy-2-octadecoxy-2-(2-pyrimidin-2-yloxypropoxy)ethyl]-trimethyl-azanium chloride

Systemtic Name: [2-ethoxy-2-octadecoxy-2-(2-pyrimidin-2-yloxypropoxy)ethyl]-trimethyl-azanium chloride Openeye Name: [2-ethoxy-2-octadecoxy-2-(2-pyrimidin-2-yloxypropoxy)ethyl]-trimethyl-ammonium chloride CAS Name: [2-ethoxy-2-octadecoxy-2-[2-(2-pyrimidinyloxy)propoxy]ethyl]-trimethylammonium chloride IUPAC Name: [2-ethoxy-2-octadecoxy-2-(2-pyrimidin-2-yloxypropoxy)ethyl]-trimethylazanium chloride Traditional Name: [2-ethoxy-2-[2-(2-pyrimidyloxy)propoxy]-2-stearyloxy-ethyl]-trimethyl-ammonium chloride Formula: C32H62ClN3O4 MolecularWeight: 588.30538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC(C[N+](C)(C)C)(OCC)OCC(C)OC1=NC=CC=N1.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC(C[N+](C)(C)C)(OCC)OCC(C)OC1=NC=CC=N1.[Cl-]

InChI

InChI=1S/C32H62N3O4.ClH/c1-7-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-27-37-32(36-8-2,29-35(4,5)6)38-28-30(3)39-31-33-25-24-26-34-31;/h24-26,30H,7-23,27-29H2,1-6H3;1H/q+1;/p-1