3-methyl-8-[2,3,5-tris(chloranyl)phenyl]-7H-purine-2,6-dione

Systemtic Name: 3-methyl-8-[2,3,5-tris(chloranyl)phenyl]-7H-purine-2,6-dione Openeye Name: 3-methyl-8-(2,3,5-trichlorophenyl)-7H-purine-2,6-dione CAS Name: 3-methyl-8-(2,3,5-trichlorophenyl)-7H-purine-2,6-dione IUPAC Name: 3-methyl-8-(2,3,5-trichlorophenyl)-7H-purine-2,6-dione Traditional Name: 3-methyl-8-(2,3,5-trichlorophenyl)-7H-purine-2,6-quinone Formula: C12H7Cl3N4O2 MolecularWeight: 345.56858

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)NC(=N2)C3=CC(=CC(=C3Cl)Cl)Cl

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)NC(=N2)C3=CC(=CC(=C3Cl)Cl)Cl

InChI

InChI=1S/C12H7Cl3N4O2/c1-19-10-8(11(20)18-12(19)21)16-9(17-10)5-2-4(13)3-6(14)7(5)15/h2-3H,1H3,(H,16,17)(H,18,20,21)