8-methyl-7-propyl-3H-purine-2,6-dione

Systemtic Name: 8-methyl-7-propyl-3H-purine-2,6-dione Openeye Name: 8-methyl-7-propyl-3H-purine-2,6-dione CAS Name: 8-methyl-7-propyl-3H-purine-2,6-dione IUPAC Name: 8-methyl-7-propyl-3H-purine-2,6-dione Traditional Name: 8-methyl-7-propyl-xanthine Formula: C9H12N4O2 MolecularWeight: 208.21718

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NC2=C1C(=O)NC(=O)N2)C

Isomeric SMILES

CCCN1C(=NC2=C1C(=O)NC(=O)N2)C

InChI

InChI=1S/C9H12N4O2/c1-3-4-13-5(2)10-7-6(13)8(14)12-9(15)11-7/h3-4H2,1-2H3,(H2,11,12,14,15)