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

Systemtic Name: 2-[2-chloranyl-6-(methylamino)purin-9-yl]propane-1,3-diol Openeye Name: 2-[2-chloro-6-(methylamino)purin-9-yl]propane-1,3-diol CAS Name: 2-[2-chloro-6-(methylamino)-9-purinyl]propane-1,3-diol IUPAC Name: 2-[2-chloro-6-(methylamino)purin-9-yl]propane-1,3-diol Traditional Name: 2-[2-chloro-6-(methylamino)purin-9-yl]propane-1,3-diol Formula: C9H12ClN5O2 MolecularWeight: 257.67688

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1N=CN2C(CO)CO)Cl

Isomeric SMILES

CNC1=NC(=NC2=C1N=CN2C(CO)CO)Cl

InChI

InChI=1S/C9H12ClN5O2/c1-11-7-6-8(14-9(10)13-7)15(4-12-6)5(2-16)3-17/h4-5,16-17H,2-3H2,1H3,(H,11,13,14)