3-[3-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfonylpropoxy]propyl methanesulfonate

Systemtic Name: 3-[3-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfonylpropoxy]propyl methanesulfonate Openeye Name: 3-[3-(3-octadecoxy-2-pyrimidin-2-yloxy-propyl)sulfonylpropoxy]propyl methanesulfonate CAS Name: methanesulfonic acid 3-[3-[3-octadecoxy-2-(2-pyrimidinyloxy)propyl]sulfonylpropoxy]propyl ester IUPAC Name: 3-[3-(3-octadecoxy-2-pyrimidin-2-yloxypropyl)sulfonylpropoxy]propyl methanesulfonate Traditional Name: methanesulfonic acid 3-[3-[2-(2-pyrimidyloxy)-3-stearyloxy-propyl]sulfonylpropoxy]propyl ester Formula: C32H60N2O8S2 MolecularWeight: 664.9574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(CS(=O)(=O)CCCOCCCOS(=O)(=O)C)OC1=NC=CC=N1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(CS(=O)(=O)CCCOCCCOS(=O)(=O)C)OC1=NC=CC=N1

InChI

InChI=1S/C32H60N2O8S2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-40-29-31(42-32-33-22-19-23-34-32)30-44(37,38)28-21-26-39-25-20-27-41-43(2,35)36/h19,22-23,31H,3-18,20-21,24-30H2,1-2H3