2-[4-(1-methyl-4-morpholin-4-yl-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-ium-1-yl]ethanol

Systemtic Name: 2-[4-(1-methyl-4-morpholin-4-yl-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-ium-1-yl]ethanol Openeye Name: 2-[4-(1-methyl-4-morpholino-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-ium-1-yl]ethanol CAS Name: 2-[4-[1-methyl-4-(4-morpholinyl)-6-pyrazolo[3,4-d]pyrimidinyl]-1-piperazin-1-iumyl]ethanol IUPAC Name: 2-[4-(1-methyl-4-morpholin-4-ylpyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-ium-1-yl]ethanol Traditional Name: 2-[4-(1-methyl-4-morpholino-pyrazolo[3,4-d]pyrimidin-6-yl)piperazin-1-ium-1-yl]ethanol Formula: C16H26N7O2+ MolecularWeight: 348.42334

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Descriptors Computed from Structure

Canonical SMILES:

CN1C2=C(C=N1)C(=NC(=N2)N3CC[NH+](CC3)CCO)N4CCOCC4

Isomeric SMILES

CN1C2=C(C=N1)C(=NC(=N2)N3CC[NH+](CC3)CCO)N4CCOCC4

InChI

InChI=1S/C16H25N7O2/c1-20-14-13(12-17-20)15(22-7-10-25-11-8-22)19-16(18-14)23-4-2-21(3-5-23)6-9-24/h12,24H,2-11H2,1H3/p+1