1-(5-oxidanylidenehexyl)-7-propyl-3H-purine-2,6-dione

Systemtic Name: 1-(5-oxidanylidenehexyl)-7-propyl-3H-purine-2,6-dione Openeye Name: 1-(5-oxohexyl)-7-propyl-3H-purine-2,6-dione CAS Name: 1-(5-oxohexyl)-7-propyl-3H-purine-2,6-dione IUPAC Name: 1-(5-oxohexyl)-7-propyl-3H-purine-2,6-dione Traditional Name: 1-(5-ketohexyl)-7-propyl-xanthine Formula: C14H20N4O3 MolecularWeight: 292.3336

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C=NC2=C1C(=O)N(C(=O)N2)CCCCC(=O)C

Isomeric SMILES

CCCN1C=NC2=C1C(=O)N(C(=O)N2)CCCCC(=O)C

InChI

InChI=1S/C14H20N4O3/c1-3-7-17-9-15-12-11(17)13(20)18(14(21)16-12)8-5-4-6-10(2)19/h9H,3-8H2,1-2H3,(H,16,21)