8-(3-methoxypropylamino)-1,3,7-trimethyl-purine-2,6-dione

Systemtic Name: 8-(3-methoxypropylamino)-1,3,7-trimethyl-purine-2,6-dione Openeye Name: 8-(3-methoxypropylamino)-1,3,7-trimethyl-purine-2,6-dione CAS Name: 8-(3-methoxypropylamino)-1,3,7-trimethylpurine-2,6-dione IUPAC Name: 8-(3-methoxypropylamino)-1,3,7-trimethylpurine-2,6-dione Traditional Name: 8-(3-methoxypropylamino)-1,3,7-trimethyl-xanthine Formula: C12H19N5O3 MolecularWeight: 281.31096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(N=C1NCCCOC)N(C(=O)N(C2=O)C)C

Isomeric SMILES

CN1C2=C(N=C1NCCCOC)N(C(=O)N(C2=O)C)C

InChI

InChI=1S/C12H19N5O3/c1-15-8-9(14-11(15)13-6-5-7-20-4)16(2)12(19)17(3)10(8)18/h5-7H2,1-4H3,(H,13,14)