2-[[3-[methyl-(phenylmethyl)amino]propylamino]methyl]-5-octadecoxy-1-(phenylmethyl)pyridin-4-one

Systemtic Name: 2-[[3-[methyl-(phenylmethyl)amino]propylamino]methyl]-5-octadecoxy-1-(phenylmethyl)pyridin-4-one Openeye Name: 1-benzyl-2-[[3-[benzyl(methyl)amino]propylamino]methyl]-5-octadecoxy-pyridin-4-one CAS Name: 2-[[3-[methyl-(phenylmethyl)amino]propylamino]methyl]-5-octadecoxy-1-(phenylmethyl)-4-pyridinone IUPAC Name: 1-benzyl-2-[[3-[benzyl(methyl)amino]propylamino]methyl]-5-octadecoxypyridin-4-one Traditional Name: 1-benzyl-2-[[3-[benzyl(methyl)amino]propylamino]methyl]-5-stearyloxy-4-pyridone Formula: C42H65N3O2 MolecularWeight: 643.9844

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CNCCCN(C)CC2=CC=CC=C2)CC3=CC=CC=C3

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CNCCCN(C)CC2=CC=CC=C2)CC3=CC=CC=C3

InChI

InChI=1S/C42H65N3O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-24-32-47-42-37-45(36-39-28-22-19-23-29-39)40(33-41(42)46)34-43-30-25-31-44(2)35-38-26-20-18-21-27-38/h18-23,26-29,33,37,43H,3-17,24-25,30-32,34-36H2,1-2H3