3-[(1-iodanylcyclopropyl)methyl]-7-propyl-purine-2,6-dione

Systemtic Name: 3-[(1-iodanylcyclopropyl)methyl]-7-propyl-purine-2,6-dione Openeye Name: 3-[(1-iodocyclopropyl)methyl]-7-propyl-purine-2,6-dione CAS Name: 3-[(1-iodocyclopropyl)methyl]-7-propylpurine-2,6-dione IUPAC Name: 3-[(1-iodocyclopropyl)methyl]-7-propylpurine-2,6-dione Traditional Name: 3-[(1-iodocyclopropyl)methyl]-7-propyl-xanthine Formula: C12H15IN4O2 MolecularWeight: 374.17757

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=O)NC(=O)N2CC3(CC3)I

Isomeric SMILES

CCCN1C=NC2=C1C(=O)NC(=O)N2CC3(CC3)I

InChI

InChI=1S/C12H15IN4O2/c1-2-5-16-7-14-9-8(16)10(18)15-11(19)17(9)6-12(13)3-4-12/h7H,2-6H2,1H3,(H,15,18,19)