3,7-dimethyl-1-oct-7-enyl-purine-2,6-dione

Systemtic Name: 3,7-dimethyl-1-oct-7-enyl-purine-2,6-dione Openeye Name: 3,7-dimethyl-1-oct-7-enyl-purine-2,6-dione CAS Name: 3,7-dimethyl-1-oct-7-enylpurine-2,6-dione IUPAC Name: 3,7-dimethyl-1-oct-7-enylpurine-2,6-dione Traditional Name: 3,7-dimethyl-1-oct-7-enyl-xanthine Formula: C15H22N4O2 MolecularWeight: 290.36078

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCC=C

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C(=O)N2C)CCCCCCC=C

InChI

InChI=1S/C15H22N4O2/c1-4-5-6-7-8-9-10-19-14(20)12-13(16-11-17(12)2)18(3)15(19)21/h4,11H,1,5-10H2,2-3H3