8-(4-chlorophenyl)-3,7-dihydropurine-2,6-dione

Systemtic Name: 8-(4-chlorophenyl)-3,7-dihydropurine-2,6-dione Openeye Name: 8-(4-chlorophenyl)-3,7-dihydropurine-2,6-dione CAS Name: 8-(4-chlorophenyl)-3,7-dihydropurine-2,6-dione IUPAC Name: 8-(4-chlorophenyl)-3,7-dihydropurine-2,6-dione Traditional Name: 8-(4-chlorophenyl)-7H-xanthine Formula: C11H7ClN4O2 MolecularWeight: 262.65188

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NC3=C(N2)C(=O)NC(=O)N3)Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NC3=C(N2)C(=O)NC(=O)N3)Cl

InChI

InChI=1S/C11H7ClN4O2/c12-6-3-1-5(2-4-6)8-13-7-9(14-8)15-11(18)16-10(7)17/h1-4H,(H3,13,14,15,16,17,18)