2-[(3-azanylpropylamino)methyl]-5-octadecoxy-1-propyl-pyridin-4-one

Systemtic Name: 2-[(3-azanylpropylamino)methyl]-5-octadecoxy-1-propyl-pyridin-4-one Openeye Name: 2-[(3-aminopropylamino)methyl]-5-octadecoxy-1-propyl-pyridin-4-one CAS Name: 2-[(3-aminopropylamino)methyl]-5-octadecoxy-1-propyl-4-pyridinone IUPAC Name: 2-[(3-aminopropylamino)methyl]-5-octadecoxy-1-propylpyridin-4-one Traditional Name: 2-[(3-aminopropylamino)methyl]-1-propyl-5-stearyloxy-4-pyridone Formula: C30H57N3O2 MolecularWeight: 491.79248

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CNCCCN)CCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCCOC1=CN(C(=CC1=O)CNCCCN)CCC

InChI

InChI=1S/C30H57N3O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-24-35-30-27-33(23-4-2)28(25-29(30)34)26-32-22-20-21-31/h25,27,32H,3-24,26,31H2,1-2H3