3-(hydroxymethyl)-5-[6-(methylamino)purin-9-yl]cyclopentane-1,2-diol hydrochloride

Systemtic Name: 3-(hydroxymethyl)-5-[6-(methylamino)purin-9-yl]cyclopentane-1,2-diol hydrochloride Openeye Name: 3-(hydroxymethyl)-5-[6-(methylamino)purin-9-yl]cyclopentane-1,2-diol hydrochloride CAS Name: 3-(hydroxymethyl)-5-[6-(methylamino)-9-purinyl]cyclopentane-1,2-diol hydrochloride IUPAC Name: 3-(hydroxymethyl)-5-[6-(methylamino)purin-9-yl]cyclopentane-1,2-diol hydrochloride Traditional Name: 3-[6-(methylamino)purin-9-yl]-5-methylol-cyclopentane-1,2-diol hydrochloride Formula: C12H18ClN5O3 MolecularWeight: 315.75602

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=NC=NC2=C1N=CN2C3CC(C(C3O)O)CO.Cl

Isomeric SMILES

CNC1=NC=NC2=C1N=CN2C3CC(C(C3O)O)CO.Cl

InChI

InChI=1S/C12H17N5O3.ClH/c1-13-11-8-12(15-4-14-11)17(5-16-8)7-2-6(3-18)9(19)10(7)20;/h4-7,9-10,18-20H,2-3H2,1H3,(H,13,14,15);1H