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

Systemtic Name: 8-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-7-(2-ethoxyethyl)-3-methyl-purine-2,6-dione Openeye Name: 8-[(3R,5R)-3,5-dimethyl-1-piperidyl]-7-(2-ethoxyethyl)-3-methyl-purine-2,6-dione CAS Name: 8-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-7-(2-ethoxyethyl)-3-methylpurine-2,6-dione IUPAC Name: 8-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-7-(2-ethoxyethyl)-3-methylpurine-2,6-dione Traditional Name: 8-[(3R,5R)-3,5-dimethylpiperidino]-7-(2-ethoxyethyl)-3-methyl-xanthine Formula: C17H27N5O3 MolecularWeight: 349.42798

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Descriptors Computed from Structure

Canonical SMILES:

CCOCCN1C2=C(N=C1N3CC(CC(C3)C)C)N(C(=O)NC2=O)C

Isomeric SMILES

CCOCCN1C2=C(N=C1N3C[C@@H](C[C@H](C3)C)C)N(C(=O)NC2=O)C

InChI

InChI=1S/C17H27N5O3/c1-5-25-7-6-22-13-14(20(4)17(24)19-15(13)23)18-16(22)21-9-11(2)8-12(3)10-21/h11-12H,5-10H2,1-4H3,(H,19,23,24)/t11-,12-/m1/s1