7-methyl-1-[2-oxidanylidene-3-[(2R,3S)-3-oxidanylpiperidin-2-yl]propyl]purin-6-one

Systemtic Name: 7-methyl-1-[2-oxidanylidene-3-[(2R,3S)-3-oxidanylpiperidin-2-yl]propyl]purin-6-one Openeye Name: 1-[3-[(2R,3S)-3-hydroxy-2-piperidyl]-2-oxo-propyl]-7-methyl-purin-6-one CAS Name: 1-[3-[(2R,3S)-3-hydroxy-2-piperidinyl]-2-oxopropyl]-7-methyl-6-purinone IUPAC Name: 1-[3-[(2R,3S)-3-hydroxypiperidin-2-yl]-2-oxopropyl]-7-methylpurin-6-one Traditional Name: 1-[3-[(2R,3S)-3-hydroxy-2-piperidyl]-2-keto-propyl]-7-methyl-purin-6-one Formula: C14H19N5O3 MolecularWeight: 305.33236

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC2=C1C(=O)N(C=N2)CC(=O)CC3C(CCCN3)O

Isomeric SMILES

CN1C=NC2=C1C(=O)N(C=N2)CC(=O)C[C@@H]3[C@H](CCCN3)O

InChI

InChI=1S/C14H19N5O3/c1-18-7-16-13-12(18)14(22)19(8-17-13)6-9(20)5-10-11(21)3-2-4-15-10/h7-8,10-11,15,21H,2-6H2,1H3/t10-,11+/m1/s1