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

Systemtic Name: 2-(bromomethyl)-1-methyl-5-octadecoxy-pyridin-4-one hydrobromide Openeye Name: 2-(bromomethyl)-1-methyl-5-octadecoxy-pyridin-4-one hydrobromide CAS Name: 2-(bromomethyl)-1-methyl-5-octadecoxy-4-pyridinone hydrobromide IUPAC Name: 2-(bromomethyl)-1-methyl-5-octadecoxypyridin-4-one hydrobromide Traditional Name: 2-(bromomethyl)-1-methyl-5-stearyloxy-4-pyridone hydrobromide Formula: C25H45Br2NO2 MolecularWeight: 551.4383

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H44BrNO2.BrH/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-29-25-22-27(2)23(21-26)20-24(25)28;/h20,22H,3-19,21H2,1-2H3;1H