8-[2,6-bis(chloranyl)phenyl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[2,6-bis(chloranyl)phenyl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-(2,6-dichlorophenyl)-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-(2,6-dichlorophenyl)-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-(2,6-dichlorophenyl)-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 8-(2,6-dichlorophenyl)-1,3-dimethyl-7H-purine-2,6-quinone Formula: C13H10Cl2N4O2 MolecularWeight: 325.1501

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=C(C=CC=C3Cl)Cl

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)C3=C(C=CC=C3Cl)Cl

InChI

InChI=1S/C13H10Cl2N4O2/c1-18-11-9(12(20)19(2)13(18)21)16-10(17-11)8-6(14)4-3-5-7(8)15/h3-5H,1-2H3,(H,16,17)