2-(bromomethyl)-5-octadecoxy-1-propyl-pyridin-4-one hydrobromide

Systemtic Name: 2-(bromomethyl)-5-octadecoxy-1-propyl-pyridin-4-one hydrobromide Openeye Name: 2-(bromomethyl)-5-octadecoxy-1-propyl-pyridin-4-one hydrobromide CAS Name: 2-(bromomethyl)-5-octadecoxy-1-propyl-4-pyridinone hydrobromide IUPAC Name: 2-(bromomethyl)-5-octadecoxy-1-propylpyridin-4-one hydrobromide Traditional Name: 2-(bromomethyl)-1-propyl-5-stearyloxy-4-pyridone hydrobromide Formula: C27H49Br2NO2 MolecularWeight: 579.49146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CBr)CCC.Br

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CBr)CCC.Br

InChI

InChI=1S/C27H48BrNO2.BrH/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-21-31-27-24-29(20-4-2)25(23-28)22-26(27)30;/h22,24H,3-21,23H2,1-2H3;1H