8-bromanyl-7-(5-chloranylpentyl)-3-methyl-purine-2,6-dione

Systemtic Name: 8-bromanyl-7-(5-chloranylpentyl)-3-methyl-purine-2,6-dione Openeye Name: 8-bromo-7-(5-chloropentyl)-3-methyl-purine-2,6-dione CAS Name: 8-bromo-7-(5-chloropentyl)-3-methylpurine-2,6-dione IUPAC Name: 8-bromo-7-(5-chloropentyl)-3-methylpurine-2,6-dione Traditional Name: 8-bromo-7-(5-chloropentyl)-3-methyl-xanthine Formula: C11H14BrClN4O2 MolecularWeight: 349.61146

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CCCCCCl

Isomeric SMILES

CN1C2=C(C(=O)NC1=O)N(C(=N2)Br)CCCCCCl

InChI

InChI=1S/C11H14BrClN4O2/c1-16-8-7(9(18)15-11(16)19)17(10(12)14-8)6-4-2-3-5-13/h2-6H2,1H3,(H,15,18,19)