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

Systemtic Name: 8-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-7-(2-methoxyethyl)-3-methyl-purine-2,6-dione Openeye Name: 8-[(3S,5S)-3,5-dimethyl-1-piperidyl]-7-(2-methoxyethyl)-3-methyl-purine-2,6-dione CAS Name: 8-[(3S,5S)-3,5-dimethyl-1-piperidinyl]-7-(2-methoxyethyl)-3-methylpurine-2,6-dione IUPAC Name: 8-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-7-(2-methoxyethyl)-3-methylpurine-2,6-dione Traditional Name: 8-[(3S,5S)-3,5-dimethylpiperidino]-7-(2-methoxyethyl)-3-methyl-xanthine Formula: C16H25N5O3 MolecularWeight: 335.4014

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C2=NC3=C(N2CCOC)C(=O)NC(=O)N3C)C

Isomeric SMILES

C[C@H]1C[C@@H](CN(C1)C2=NC3=C(N2CCOC)C(=O)NC(=O)N3C)C

InChI

InChI=1S/C16H25N5O3/c1-10-7-11(2)9-20(8-10)15-17-13-12(21(15)5-6-24-4)14(22)18-16(23)19(13)3/h10-11H,5-9H2,1-4H3,(H,18,22,23)/t10-,11-/m0/s1