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

Systemtic Name: 2-[[3-(dimethylamino)propylamino]methyl]-5-octadecoxy-1-[(4-phenylmethoxyphenyl)methyl]pyridin-4-one Openeye Name: 1-[(4-benzyloxyphenyl)methyl]-2-[[3-(dimethylamino)propylamino]methyl]-5-octadecoxy-pyridin-4-one CAS Name: 2-[[3-(dimethylamino)propylamino]methyl]-5-octadecoxy-1-[(4-phenylmethoxyphenyl)methyl]-4-pyridinone IUPAC Name: 2-[[3-(dimethylamino)propylamino]methyl]-5-octadecoxy-1-[(4-phenylmethoxyphenyl)methyl]pyridin-4-one Traditional Name: 1-(4-benzoxybenzyl)-2-[[3-(dimethylamino)propylamino]methyl]-5-stearyloxy-4-pyridone Formula: C43H67N3O3 MolecularWeight: 674.01038

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CNCCCN(C)C)CC2=CC=C(C=C2)OCC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CNCCCN(C)C)CC2=CC=C(C=C2)OCC3=CC=CC=C3

InChI

InChI=1S/C43H67N3O3/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-22-32-48-43-36-46(40(33-42(43)47)34-44-30-23-31-45(2)3)35-38-26-28-41(29-27-38)49-37-39-24-20-19-21-25-39/h19-21,24-29,33,36,44H,4-18,22-23,30-32,34-35,37H2,1-3H3