4-[1-octadecoxy-3-[2-(2-pyridin-1-ium-1-ylethoxy)ethoxy]propan-2-yl]oxypyrimidine chloride

Systemtic Name: 4-[1-octadecoxy-3-[2-(2-pyridin-1-ium-1-ylethoxy)ethoxy]propan-2-yl]oxypyrimidine chloride Openeye Name: 4-[1-(octadecoxymethyl)-2-[2-(2-pyridin-1-ium-1-ylethoxy)ethoxy]ethoxy]pyrimidine chloride CAS Name: 4-[1-octadecoxy-3-[2-[2-(1-pyridin-1-iumyl)ethoxy]ethoxy]propan-2-yl]oxypyrimidine chloride IUPAC Name: 4-[1-octadecoxy-3-[2-(2-pyridin-1-ium-1-ylethoxy)ethoxy]propan-2-yl]oxypyrimidine chloride Traditional Name: 4-[1-[2-(2-pyridin-1-ium-1-ylethoxy)ethoxymethyl]-2-stearyloxy-ethoxy]pyrimidine chloride Formula: C34H58ClN3O4 MolecularWeight: 608.29502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COCCOCC[N+]1=CC=CC=C1)OC2=NC=NC=C2.[Cl-]

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COCCOCC[N+]1=CC=CC=C1)OC2=NC=NC=C2.[Cl-]

InChI

InChI=1S/C34H58N3O4.ClH/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-26-39-30-33(41-34-21-22-35-32-36-34)31-40-29-28-38-27-25-37-23-18-17-19-24-37;/h17-19,21-24,32-33H,2-16,20,25-31H2,1H3;1H/q+1;/p-1