4-(3-octadecoxy-2-pyrimidin-2-yloxy-propoxy)butyl methanesulfonate

Systemtic Name: 4-(3-octadecoxy-2-pyrimidin-2-yloxy-propoxy)butyl methanesulfonate Openeye Name: 4-(3-octadecoxy-2-pyrimidin-2-yloxy-propoxy)butyl methanesulfonate CAS Name: methanesulfonic acid 4-[3-octadecoxy-2-(2-pyrimidinyloxy)propoxy]butyl ester IUPAC Name: 4-(3-octadecoxy-2-pyrimidin-2-yloxypropoxy)butyl methanesulfonate Traditional Name: methanesulfonic acid 4-[2-(2-pyrimidyloxy)-3-stearyloxy-propoxy]butyl ester Formula: C30H56N2O6S MolecularWeight: 572.84044

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOCC(COCCCCOS(=O)(=O)C)OC1=NC=CC=N1

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOCC(COCCCCOS(=O)(=O)C)OC1=NC=CC=N1

InChI

InChI=1S/C30H56N2O6S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-24-35-27-29(38-30-31-22-21-23-32-30)28-36-25-19-20-26-37-39(2,33)34/h21-23,29H,3-20,24-28H2,1-2H3