1,3-dimethyl-7-(1-oxidanylpropyl)purine-2,6-dione

Systemtic Name: 1,3-dimethyl-7-(1-oxidanylpropyl)purine-2,6-dione Openeye Name: 7-(1-hydroxypropyl)-1,3-dimethyl-purine-2,6-dione CAS Name: 7-(1-hydroxypropyl)-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-(1-hydroxypropyl)-1,3-dimethylpurine-2,6-dione Traditional Name: 7-(1-hydroxypropyl)-1,3-dimethyl-xanthine Formula: C10H14N4O3 MolecularWeight: 238.24316

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Descriptors Computed from Structure

Canonical SMILES:

CCC(N1C=NC2=C1C(=O)N(C(=O)N2C)C)O

Isomeric SMILES

CCC(N1C=NC2=C1C(=O)N(C(=O)N2C)C)O

InChI

InChI=1S/C10H14N4O3/c1-4-6(15)14-5-11-8-7(14)9(16)13(3)10(17)12(8)2/h5-6,15H,4H2,1-3H3