2-[3-[6-(methylamino)purin-9-yl]propyl]propane-1,3-diol

Systemtic Name: 2-[3-[6-(methylamino)purin-9-yl]propyl]propane-1,3-diol Openeye Name: 2-[3-[6-(methylamino)purin-9-yl]propyl]propane-1,3-diol CAS Name: 2-[3-[6-(methylamino)-9-purinyl]propyl]propane-1,3-diol IUPAC Name: 2-[3-[6-(methylamino)purin-9-yl]propyl]propane-1,3-diol Traditional Name: 2-[3-[6-(methylamino)purin-9-yl]propyl]propane-1,3-diol Formula: C12H19N5O2 MolecularWeight: 265.31156

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC2=C1N=CN2CCCC(CO)CO

Isomeric SMILES

CNC1=NC=NC2=C1N=CN2CCCC(CO)CO

InChI

InChI=1S/C12H19N5O2/c1-13-11-10-12(15-7-14-11)17(8-16-10)4-2-3-9(5-18)6-19/h7-9,18-19H,2-6H2,1H3,(H,13,14,15)