9-(2-hydroxyethyl)-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 9-(2-hydroxyethyl)-1,3-dimethyl-purine-2,6-dione Openeye Name: 9-(2-hydroxyethyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 9-(2-hydroxyethyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 9-(2-hydroxyethyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 9-(2-hydroxyethyl)-1,3-dimethyl-xanthine Formula: C9H12N4O3 MolecularWeight: 224.21658

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)N=CN2CCO

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)N=CN2CCO

InChI

InChI=1S/C9H12N4O3/c1-11-7-6(8(15)12(2)9(11)16)10-5-13(7)3-4-14/h5,14H,3-4H2,1-2H3