7-methoxy-1,3,8-trimethyl-purine-2,6-dione

Systemtic Name: 7-methoxy-1,3,8-trimethyl-purine-2,6-dione Openeye Name: 7-methoxy-1,3,8-trimethyl-purine-2,6-dione CAS Name: 7-methoxy-1,3,8-trimethylpurine-2,6-dione IUPAC Name: 7-methoxy-1,3,8-trimethylpurine-2,6-dione Traditional Name: 7-methoxy-1,3,8-trimethyl-xanthine Formula: C9H12N4O3 MolecularWeight: 224.21658

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(N1OC)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CC1=NC2=C(N1OC)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C9H12N4O3/c1-5-10-7-6(13(5)16-4)8(14)12(3)9(15)11(7)2/h1-4H3