7-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-3-oxidanylidene-propyl]-1,3-dimethyl-purine-2,6-dione

Systemtic Name: 7-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-3-oxidanylidene-propyl]-1,3-dimethyl-purine-2,6-dione Openeye Name: 7-[3-[(3R,5R)-3,5-dimethyl-1-piperidyl]-3-oxo-propyl]-1,3-dimethyl-purine-2,6-dione CAS Name: 7-[3-[(3R,5R)-3,5-dimethyl-1-piperidinyl]-3-oxopropyl]-1,3-dimethylpurine-2,6-dione IUPAC Name: 7-[3-[(3R,5R)-3,5-dimethylpiperidin-1-yl]-3-oxopropyl]-1,3-dimethylpurine-2,6-dione Traditional Name: 7-[3-[(3R,5R)-3,5-dimethylpiperidino]-3-keto-propyl]-1,3-dimethyl-xanthine Formula: C17H25N5O3 MolecularWeight: 347.4121

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(CN(C1)C(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C)C

Isomeric SMILES

C[C@@H]1C[C@H](CN(C1)C(=O)CCN2C=NC3=C2C(=O)N(C(=O)N3C)C)C

InChI

InChI=1S/C17H25N5O3/c1-11-7-12(2)9-22(8-11)13(23)5-6-21-10-18-15-14(21)16(24)20(4)17(25)19(15)3/h10-12H,5-9H2,1-4H3/t11-,12-/m1/s1