8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-octyl-purine-2,6-dione

Systemtic Name: 8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-octyl-purine-2,6-dione Openeye Name: 8-[(3,5-dimethyl-1-piperidyl)methyl]-1,3-dimethyl-7-octyl-purine-2,6-dione CAS Name: 8-[(3,5-dimethyl-1-piperidinyl)methyl]-1,3-dimethyl-7-octylpurine-2,6-dione IUPAC Name: 8-[(3,5-dimethylpiperidin-1-yl)methyl]-1,3-dimethyl-7-octylpurine-2,6-dione Traditional Name: 8-[(3,5-dimethylpiperidino)methyl]-1,3-dimethyl-7-octyl-xanthine Formula: C23H39N5O2 MolecularWeight: 417.58806

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CC(CC(C3)C)C

Isomeric SMILES

CCCCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CC(CC(C3)C)C

InChI

InChI=1S/C23H39N5O2/c1-6-7-8-9-10-11-12-28-19(16-27-14-17(2)13-18(3)15-27)24-21-20(28)22(29)26(5)23(30)25(21)4/h17-18H,6-16H2,1-5H3