5-octadecoxy-2-(3-oxidanylpropyl)-1-(phenylmethyl)pyridin-4-one

Systemtic Name: 5-octadecoxy-2-(3-oxidanylpropyl)-1-(phenylmethyl)pyridin-4-one Openeye Name: 1-benzyl-2-(3-hydroxypropyl)-5-octadecoxy-pyridin-4-one CAS Name: 2-(3-hydroxypropyl)-5-octadecoxy-1-(phenylmethyl)-4-pyridinone IUPAC Name: 1-benzyl-2-(3-hydroxypropyl)-5-octadecoxypyridin-4-one Traditional Name: 1-benzyl-2-(3-hydroxypropyl)-5-stearyloxy-4-pyridone Formula: C33H53NO3 MolecularWeight: 511.77882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C33H53NO3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-26-37-33-29-34(28-30-22-18-17-19-23-30)31(24-21-25-35)27-32(33)36/h17-19,22-23,27,29,35H,2-16,20-21,24-26,28H2,1H3