8-chloranyl-7-[2-(2-fluorophenyl)-2-oxidanyl-ethyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 8-chloranyl-7-[2-(2-fluorophenyl)-2-oxidanyl-ethyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-chloro-7-[2-(2-fluorophenyl)-2-hydroxy-ethyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 8-chloro-7-[2-(2-fluorophenyl)-2-hydroxyethyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-chloro-7-[2-(2-fluorophenyl)-2-hydroxyethyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 8-chloro-7-[2-(2-fluorophenyl)-2-hydroxy-ethyl]-1,3-dimethyl-xanthine Formula: C15H14ClFN4O3 MolecularWeight: 352.748063

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC(C3=CC=CC=C3F)O

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)Cl)CC(C3=CC=CC=C3F)O

InChI

InChI=1S/C15H14ClFN4O3/c1-19-12-11(13(23)20(2)15(19)24)21(14(16)18-12)7-10(22)8-5-3-4-6-9(8)17/h3-6,10,22H,7H2,1-2H3