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

Systemtic Name: 8-chloranyl-7-(chloromethyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-chloro-7-(chloromethyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-chloro-7-(chloromethyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-chloro-7-(chloromethyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 8-chloro-7-(chloromethyl)-1,3-dimethyl-xanthine Formula: C8H8Cl2N4O2 MolecularWeight: 263.08072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H8Cl2N4O2/c1-12-5-4(6(15)13(2)8(12)16)14(3-9)7(10)11-5/h3H2,1-2H3