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

Systemtic Name: 5-octadecoxy-2-[(3-oxidanylpropylamino)methyl]-1-(phenylmethyl)pyridin-4-one Openeye Name: 1-benzyl-2-[(3-hydroxypropylamino)methyl]-5-octadecoxy-pyridin-4-one CAS Name: 2-[(3-hydroxypropylamino)methyl]-5-octadecoxy-1-(phenylmethyl)-4-pyridinone IUPAC Name: 1-benzyl-2-[(3-hydroxypropylamino)methyl]-5-octadecoxypyridin-4-one Traditional Name: 1-benzyl-2-[(3-hydroxypropylamino)methyl]-5-stearyloxy-4-pyridone Formula: C34H56N2O3 MolecularWeight: 540.82004

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C34H56N2O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-20-26-39-34-30-36(29-31-22-18-17-19-23-31)32(27-33(34)38)28-35-24-21-25-37/h17-19,22-23,27,30,35,37H,2-16,20-21,24-26,28-29H2,1H3