8-(2,4-dichlorophenyl)-3-methyl-purin-3-ium-2,6-dione

Systemtic Name: 8-(2,4-dichlorophenyl)-3-methyl-purin-3-ium-2,6-dione Openeye Name: 8-(2,4-dichlorophenyl)-3-methyl-purin-3-ium-2,6-dione CAS Name: 8-(2,4-dichlorophenyl)-3-methylpurin-3-ium-2,6-dione IUPAC Name: 8-(2,4-dichlorophenyl)-3-methylpurin-3-ium-2,6-dione Traditional Name: 8-(2,4-dichlorophenyl)-3-methyl-purin-3-ium-2,6-quinone Formula: C12H7Cl2N4O2+ MolecularWeight: 310.11558

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C2C(=NC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)NC1=O

Isomeric SMILES

C[N+]1=C2C(=NC(=N2)C3=C(C=C(C=C3)Cl)Cl)C(=O)NC1=O

InChI

InChI=1S/C12H6Cl2N4O2/c1-18-10-8(11(19)17-12(18)20)15-9(16-10)6-3-2-5(13)4-7(6)14/h2-4H,1H3/p+1