7-(2-chlorophenyl)-3-methyl-purine-2,6-dione

Systemtic Name: 7-(2-chlorophenyl)-3-methyl-purine-2,6-dione Openeye Name: 7-(2-chlorophenyl)-3-methyl-purine-2,6-dione CAS Name: 7-(2-chlorophenyl)-3-methylpurine-2,6-dione IUPAC Name: 7-(2-chlorophenyl)-3-methylpurine-2,6-dione Traditional Name: 7-(2-chlorophenyl)-3-methyl-xanthine Formula: C12H9ClN4O2 MolecularWeight: 276.67846

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C=N2)C3=CC=CC=C3Cl

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C=N2)C3=CC=CC=C3Cl

InChI

InChI=1S/C12H9ClN4O2/c1-16-10-9(11(18)15-12(16)19)17(6-14-10)8-5-3-2-4-7(8)13/h2-6H,1H3,(H,15,18,19)