7-[2-(4-bromanylphenoxy)ethyl]-8-chloranyl-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[2-(4-bromanylphenoxy)ethyl]-8-chloranyl-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[2-(4-bromophenoxy)ethyl]-8-chloro-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[2-(4-bromophenoxy)ethyl]-8-chloro-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[2-(4-bromophenoxy)ethyl]-8-chloro-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[2-(4-bromophenoxy)ethyl]-8-chloro-1,3-dimethyl-xanthine Formula: C15H14BrClN4O3 MolecularWeight: 413.65366

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CCOC3=CC=C(C=C3)Br

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CCOC3=CC=C(C=C3)Br

InChI

InChI=1S/C15H14BrClN4O3/c1-19-12-11(13(22)20(2)15(19)23)21(14(17)18-12)7-8-24-10-5-3-9(16)4-6-10/h3-6H,7-8H2,1-2H3