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

Systemtic Name: 8-(chloromethyl)-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-(chloromethyl)-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-(chloromethyl)-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-(chloromethyl)-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-(chloromethyl)-1,3-dimethyl-7H-purine-2,6-quinone Formula: C8H9ClN4O2 MolecularWeight: 228.63566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C8H9ClN4O2/c1-12-6-5(10-4(3-9)11-6)7(14)13(2)8(12)15/h3H2,1-2H3,(H,10,11)