8-ethyl-3,7-dimethyl-purine-2,6-dione

Systemtic Name: 8-ethyl-3,7-dimethyl-purine-2,6-dione Openeye Name: 8-ethyl-3,7-dimethyl-purine-2,6-dione CAS Name: 8-ethyl-3,7-dimethylpurine-2,6-dione IUPAC Name: 8-ethyl-3,7-dimethylpurine-2,6-dione Traditional Name: 8-ethyl-3,7-dimethyl-xanthine Formula: C9H12N4O2 MolecularWeight: 208.21718

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(N1C)C(=O)NC(=O)N2C

Isomeric SMILES

CCC1=NC2=C(N1C)C(=O)NC(=O)N2C

InChI

InChI=1S/C9H12N4O2/c1-4-5-10-7-6(12(5)2)8(14)11-9(15)13(7)3/h4H2,1-3H3,(H,11,14,15)