7-(chloromethyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-(chloromethyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-(chloromethyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(chloromethyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(chloromethyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(chloromethyl)-1,3-dimethyl-xanthine Formula: C8H9ClN4O2 MolecularWeight: 228.63566

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCl

InChI

InChI=1S/C8H9ClN4O2/c1-11-6-5(13(3-9)4-10-6)7(14)12(2)8(11)15/h4H,3H2,1-2H3