1-(4-bromophenyl)-3,7-dihydropurine-2,6-dione

Systemtic Name: 1-(4-bromophenyl)-3,7-dihydropurine-2,6-dione Openeye Name: 1-(4-bromophenyl)-3,7-dihydropurine-2,6-dione CAS Name: 1-(4-bromophenyl)-3,7-dihydropurine-2,6-dione IUPAC Name: 1-(4-bromophenyl)-3,7-dihydropurine-2,6-dione Traditional Name: 1-(4-bromophenyl)-7H-xanthine Formula: C11H7BrN4O2 MolecularWeight: 307.10288

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1N2C(=O)C3=C(NC2=O)N=CN3)Br

Isomeric SMILES

C1=CC(=CC=C1N2C(=O)C3=C(NC2=O)N=CN3)Br

InChI

InChI=1S/C11H7BrN4O2/c12-6-1-3-7(4-2-6)16-10(17)8-9(14-5-13-8)15-11(16)18/h1-5H,(H,13,14)(H,15,18)