8-bromanyl-1-(2-hydroxyethyl)-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 8-bromanyl-1-(2-hydroxyethyl)-3,7-dimethyl-purine-2,6-dione Openeye Name: 8-bromo-1-(2-hydroxyethyl)-3,7-dimethyl-purine-2,6-dione CAS Name: 8-bromo-1-(2-hydroxyethyl)-3,7-dimethylpurine-2,6-dione IUPAC Name: 8-bromo-1-(2-hydroxyethyl)-3,7-dimethylpurine-2,6-dione Traditional Name: 8-bromo-1-(2-hydroxyethyl)-3,7-dimethyl-xanthine Formula: C9H11BrN4O3 MolecularWeight: 303.11264

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1Br)N(C(=O)N(C2=O)CCO)C

Isomeric SMILES

CN1C2=C(N=C1Br)N(C(=O)N(C2=O)CCO)C

InChI

InChI=1S/C9H11BrN4O3/c1-12-5-6(11-8(12)10)13(2)9(17)14(3-4-15)7(5)16/h15H,3-4H2,1-2H3