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

Systemtic Name: 2-[[3-(dimethylamino)propylamino]methyl]-1-[(4-methylphenyl)methyl]-5-octadecoxy-pyridin-4-one Openeye Name: 2-[[3-(dimethylamino)propylamino]methyl]-5-octadecoxy-1-(p-tolylmethyl)pyridin-4-one CAS Name: 2-[[3-(dimethylamino)propylamino]methyl]-1-[(4-methylphenyl)methyl]-5-octadecoxy-4-pyridinone IUPAC Name: 2-[[3-(dimethylamino)propylamino]methyl]-1-[(4-methylphenyl)methyl]-5-octadecoxypyridin-4-one Traditional Name: 2-[[3-(dimethylamino)propylamino]methyl]-1-(4-methylbenzyl)-5-stearyloxy-4-pyridone Formula: C37H63N3O2 MolecularWeight: 581.91502

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CNCCCN(C)C)CC2=CC=C(C=C2)C

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CNCCCN(C)C)CC2=CC=C(C=C2)C

InChI

InChI=1S/C37H63N3O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28-42-37-32-40(31-34-24-22-33(2)23-25-34)35(29-36(37)41)30-38-26-21-27-39(3)4/h22-25,29,32,38H,5-21,26-28,30-31H2,1-4H3