1,3-dimethyl-7-oxidanyl-8-propyl-purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-oxidanyl-8-propyl-purine-2,6-dione Openeye Name: 7-hydroxy-1,3-dimethyl-8-propyl-purine-2,6-dione CAS Name: 7-hydroxy-1,3-dimethyl-8-propylpurine-2,6-dione IUPAC Name: 7-hydroxy-1,3-dimethyl-8-propylpurine-2,6-dione Traditional Name: 7-hydroxy-1,3-dimethyl-8-propyl-xanthine Formula: C10H14N4O3 MolecularWeight: 238.24316

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(N1O)C(=O)N(C(=O)N2C)C

Isomeric SMILES

CCCC1=NC2=C(N1O)C(=O)N(C(=O)N2C)C

InChI

InChI=1S/C10H14N4O3/c1-4-5-6-11-8-7(14(6)17)9(15)13(3)10(16)12(8)2/h17H,4-5H2,1-3H3