2-[[bis(pyridin-3-ylmethyl)amino]methyl]-6-(hydroxymethyl)-3-oxidanyl-pyran-4-one

Systemtic Name: 2-[[bis(pyridin-3-ylmethyl)amino]methyl]-6-(hydroxymethyl)-3-oxidanyl-pyran-4-one Openeye Name: 2-[[bis(3-pyridylmethyl)amino]methyl]-3-hydroxy-6-(hydroxymethyl)pyran-4-one CAS Name: 2-[[bis(3-pyridinylmethyl)amino]methyl]-3-hydroxy-6-(hydroxymethyl)-4-pyranone IUPAC Name: 2-[[bis(pyridin-3-ylmethyl)amino]methyl]-3-hydroxy-6-(hydroxymethyl)pyran-4-one Traditional Name: 2-[[bis(3-pyridylmethyl)amino]methyl]-3-hydroxy-6-methylol-pyran-4-one Formula: C19H19N3O4 MolecularWeight: 353.37186

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CN(CC2=CN=CC=C2)CC3=C(C(=O)C=C(O3)CO)O

Isomeric SMILES

C1=CC(=CN=C1)CN(CC2=CN=CC=C2)CC3=C(C(=O)C=C(O3)CO)O

InChI

InChI=1S/C19H19N3O4/c23-13-16-7-17(24)19(25)18(26-16)12-22(10-14-3-1-5-20-8-14)11-15-4-2-6-21-9-15/h1-9,23,25H,10-13H2