2-[2-chloranyl-6-(methylamino)purin-9-yl]ethanoic acid

Systemtic Name: 2-[2-chloranyl-6-(methylamino)purin-9-yl]ethanoic acid Openeye Name: 2-[2-chloro-6-(methylamino)purin-9-yl]acetic acid CAS Name: 2-[2-chloro-6-(methylamino)-9-purinyl]acetic acid IUPAC Name: 2-[2-chloro-6-(methylamino)purin-9-yl]acetic acid Traditional Name: 2-[2-chloro-6-(methylamino)purin-9-yl]acetic acid Formula: C8H8ClN5O2 MolecularWeight: 241.63442

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC(=NC2=C1N=CN2CC(=O)O)Cl

Isomeric SMILES

CNC1=NC(=NC2=C1N=CN2CC(=O)O)Cl

InChI

InChI=1S/C8H8ClN5O2/c1-10-6-5-7(13-8(9)12-6)14(3-11-5)2-4(15)16/h3H,2H2,1H3,(H,15,16)(H,10,12,13)