1-piperidin-1-yl-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanone

Systemtic Name: 1-piperidin-1-yl-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanone Openeye Name: 1-(1-piperidyl)-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanone CAS Name: 1-(1-piperidinyl)-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)-1-piperazin-1-iumyl]ethanone IUPAC Name: 1-piperidin-1-yl-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanone Traditional Name: 1-piperidino-2-[4-(1H-pyrazolo[3,4-d]pyrimidin-4-yl)piperazin-1-ium-1-yl]ethanone Formula: C16H24N7O+ MolecularWeight: 330.40806

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C3=NC=NC4=C3C=NN4

Isomeric SMILES

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C3=NC=NC4=C3C=NN4

InChI

InChI=1S/C16H23N7O/c24-14(22-4-2-1-3-5-22)11-21-6-8-23(9-7-21)16-13-10-19-20-15(13)17-12-18-16/h10,12H,1-9,11H2,(H,17,18,19,20)/p+1