8-cyclopentyl-1-propyl-purine-2,6-dione

Systemtic Name: 8-cyclopentyl-1-propyl-purine-2,6-dione Openeye Name: 8-cyclopentyl-1-propyl-purine-2,6-dione CAS Name: 8-cyclopentyl-1-propylpurine-2,6-dione IUPAC Name: 8-cyclopentyl-1-propylpurine-2,6-dione Traditional Name: 8-cyclopentyl-1-propyl-xanthine Formula: C13H16N4O2 MolecularWeight: 260.29174

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=O)C2=NC(=NC2=NC1=O)C3CCCC3

Isomeric SMILES

CCCN1C(=O)C2=NC(=NC2=NC1=O)C3CCCC3

InChI

InChI=1S/C13H16N4O2/c1-2-7-17-12(18)9-11(16-13(17)19)15-10(14-9)8-5-3-4-6-8/h8H,2-7H2,1H3