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

Systemtic Name: 8-[(3,5-dimethylpiperidin-1-yl)methyl]-7-heptyl-1,3-dimethyl-purine-2,6-dione Openeye Name: 8-[(3,5-dimethyl-1-piperidyl)methyl]-7-heptyl-1,3-dimethyl-purine-2,6-dione CAS Name: 8-[(3,5-dimethyl-1-piperidinyl)methyl]-7-heptyl-1,3-dimethylpurine-2,6-dione IUPAC Name: 8-[(3,5-dimethylpiperidin-1-yl)methyl]-7-heptyl-1,3-dimethylpurine-2,6-dione Traditional Name: 8-[(3,5-dimethylpiperidino)methyl]-7-heptyl-1,3-dimethyl-xanthine Formula: C22H37N5O2 MolecularWeight: 403.56148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CC(CC(C3)C)C

Isomeric SMILES

CCCCCCCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CC(CC(C3)C)C

InChI

InChI=1S/C22H37N5O2/c1-6-7-8-9-10-11-27-18(15-26-13-16(2)12-17(3)14-26)23-20-19(27)21(28)25(5)22(29)24(20)4/h16-17H,6-15H2,1-5H3