1-(2-hydroxyethyl)-5-(2-morpholin-4-ium-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-one

Systemtic Name: 1-(2-hydroxyethyl)-5-(2-morpholin-4-ium-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-one Openeye Name: 1-(2-hydroxyethyl)-5-(2-morpholin-4-ium-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-one CAS Name: 1-(2-hydroxyethyl)-5-[2-(4-morpholin-4-iumyl)ethyl]-4-pyrazolo[3,4-d]pyrimidinone IUPAC Name: 1-(2-hydroxyethyl)-5-(2-morpholin-4-ium-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-one Traditional Name: 1-(2-hydroxyethyl)-5-(2-morpholin-4-ium-4-ylethyl)pyrazolo[3,4-d]pyrimidin-4-one Formula: C13H20N5O3+ MolecularWeight: 294.3296

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CCN2C=NC3=C(C2=O)C=NN3CCO

Isomeric SMILES

C1COCC[NH+]1CCN2C=NC3=C(C2=O)C=NN3CCO

InChI

InChI=1S/C13H19N5O3/c19-6-3-18-12-11(9-15-18)13(20)17(10-14-12)2-1-16-4-7-21-8-5-16/h9-10,19H,1-8H2/p+1