8-[(2S)-2-(hydroxymethyl)piperidin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione

Systemtic Name: 8-[(2S)-2-(hydroxymethyl)piperidin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione Openeye Name: 8-[(2S)-2-(hydroxymethyl)-1-piperidyl]-1,3-dimethyl-7H-purine-2,6-dione CAS Name: 8-[(2S)-2-(hydroxymethyl)-1-piperidinyl]-1,3-dimethyl-7H-purine-2,6-dione IUPAC Name: 8-[(2S)-2-(hydroxymethyl)piperidin-1-yl]-1,3-dimethyl-7H-purine-2,6-dione Traditional Name: 1,3-dimethyl-8-[(2S)-2-methylolpiperidino]-7H-purine-2,6-quinone Formula: C13H19N5O3 MolecularWeight: 293.32166

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCCCC3CO

Isomeric SMILES

CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCCC[C@H]3CO

InChI

InChI=1S/C13H19N5O3/c1-16-10-9(11(20)17(2)13(16)21)14-12(15-10)18-6-4-3-5-8(18)7-19/h8,19H,3-7H2,1-2H3,(H,14,15)/t8-/m0/s1