3-[[4-(dimethylamino)-6-(hydroxymethyl)pyridin-2-yl]methyl-(pyridin-2-ylmethyl)amino]-N-octadecyl-propanamide

Systemtic Name: 3-[[4-(dimethylamino)-6-(hydroxymethyl)pyridin-2-yl]methyl-(pyridin-2-ylmethyl)amino]-N-octadecyl-propanamide Openeye Name: 3-[[4-(dimethylamino)-6-(hydroxymethyl)-2-pyridyl]methyl-(2-pyridylmethyl)amino]-N-octadecyl-propanamide CAS Name: 3-[[4-(dimethylamino)-6-(hydroxymethyl)-2-pyridinyl]methyl-(2-pyridinylmethyl)amino]-N-octadecylpropanamide IUPAC Name: 3-[[4-(dimethylamino)-6-(hydroxymethyl)pyridin-2-yl]methyl-(pyridin-2-ylmethyl)amino]-N-octadecylpropanamide Traditional Name: 3-[[4-(dimethylamino)-6-methylol-2-pyridyl]methyl-(2-pyridylmethyl)amino]-N-stearyl-propionamide Formula: C36H61N5O2 MolecularWeight: 595.90184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)CCN(CC1=CC=CC=N1)CC2=NC(=CC(=C2)N(C)C)CO

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)CCN(CC1=CC=CC=N1)CC2=NC(=CC(=C2)N(C)C)CO

InChI

InChI=1S/C36H61N5O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-25-38-36(43)23-26-41(29-32-22-19-21-24-37-32)30-33-27-35(40(2)3)28-34(31-42)39-33/h19,21-22,24,27-28,42H,4-18,20,23,25-26,29-31H2,1-3H3,(H,38,43)