8-chloranyl-7-(3-methoxypropyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-chloranyl-7-(3-methoxypropyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-chloro-7-(3-methoxypropyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 8-chloro-7-(3-methoxypropyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-chloro-7-(3-methoxypropyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 8-chloro-7-(3-methoxypropyl)-1,3-dimethyl-xanthine Formula: C11H15ClN4O3 MolecularWeight: 286.7148

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CCCOC

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CCCOC

InChI

InChI=1S/C11H15ClN4O3/c1-14-8-7(9(17)15(2)11(14)18)16(10(12)13-8)5-4-6-19-3/h4-6H2,1-3H3