2-[[3-(dimethylamino)propylamino]methyl]-5-octadecoxy-1-phenyl-pyridin-4-one

Systemtic Name: 2-[[3-(dimethylamino)propylamino]methyl]-5-octadecoxy-1-phenyl-pyridin-4-one Openeye Name: 2-[[3-(dimethylamino)propylamino]methyl]-5-octadecoxy-1-phenyl-pyridin-4-one CAS Name: 2-[[3-(dimethylamino)propylamino]methyl]-5-octadecoxy-1-phenyl-4-pyridinone IUPAC Name: 2-[[3-(dimethylamino)propylamino]methyl]-5-octadecoxy-1-phenylpyridin-4-one Traditional Name: 2-[[3-(dimethylamino)propylamino]methyl]-1-phenyl-5-stearyloxy-4-pyridone Formula: C35H59N3O2 MolecularWeight: 553.86186

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CNCCCN(C)C)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CNCCCN(C)C)C2=CC=CC=C2

InChI

InChI=1S/C35H59N3O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-28-40-35-31-38(32-24-20-19-21-25-32)33(29-34(35)39)30-36-26-23-27-37(2)3/h19-21,24-25,29,31,36H,4-18,22-23,26-28,30H2,1-3H3