9-(2,4-dichlorophenyl)carbonyl-3H-purine-2,6-dione

Systemtic Name: 9-(2,4-dichlorophenyl)carbonyl-3H-purine-2,6-dione Openeye Name: 9-(2,4-dichlorobenzoyl)-3H-purine-2,6-dione CAS Name: 9-[(2,4-dichlorophenyl)-oxomethyl]-3H-purine-2,6-dione IUPAC Name: 9-(2,4-dichlorobenzoyl)-3H-purine-2,6-dione Traditional Name: 9-(2,4-dichlorobenzoyl)xanthine Formula: C12H6Cl2N4O3 MolecularWeight: 325.10704

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)C(=O)N2C=NC3=C2NC(=O)NC3=O

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)C(=O)N2C=NC3=C2NC(=O)NC3=O

InChI

InChI=1S/C12H6Cl2N4O3/c13-5-1-2-6(7(14)3-5)11(20)18-4-15-8-9(18)16-12(21)17-10(8)19/h1-4H,(H2,16,17,19,21)