1-(3-bromanylpropyl)-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 1-(3-bromanylpropyl)-3,7-dimethyl-purine-2,6-dione Openeye Name: 1-(3-bromopropyl)-3,7-dimethyl-purine-2,6-dione CAS Name: 1-(3-bromopropyl)-3,7-dimethylpurine-2,6-dione IUPAC Name: 1-(3-bromopropyl)-3,7-dimethylpurine-2,6-dione Traditional Name: 1-(3-bromopropyl)-3,7-dimethyl-xanthine Formula: C10H13BrN4O2 MolecularWeight: 301.13982

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCBr

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCBr

InChI

InChI=1S/C10H13BrN4O2/c1-13-6-12-8-7(13)9(16)15(5-3-4-11)10(17)14(8)2/h6H,3-5H2,1-2H3