7-[2-[butyl(oxidanyl)amino]ethyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[2-[butyl(oxidanyl)amino]ethyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[2-[butyl(hydroxy)amino]ethyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[2-[butyl(hydroxy)amino]ethyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[2-[butyl(hydroxy)amino]ethyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[2-[butyl(hydroxy)amino]ethyl]-1,3-dimethyl-xanthine Formula: C13H21N5O3 MolecularWeight: 295.33754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCN1C=NC2=C1C(=O)N(C(=O)N2C)C)O

Isomeric SMILES

CCCCN(CCN1C=NC2=C1C(=O)N(C(=O)N2C)C)O

InChI

InChI=1S/C13H21N5O3/c1-4-5-6-18(21)8-7-17-9-14-11-10(17)12(19)16(3)13(20)15(11)2/h9,21H,4-8H2,1-3H3