4-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]-1H-pyrazolo[3,4-d]pyrimidine

Systemtic Name: 4-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]-1H-pyrazolo[3,4-d]pyrimidine Openeye Name: 4-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]-1H-pyrazolo[3,4-d]pyrimidine CAS Name: 4-[4-(pyridin-4-ylmethyl)-1-piperazin-4-iumyl]-1H-pyrazolo[3,4-d]pyrimidine IUPAC Name: 4-[4-(pyridin-4-ylmethyl)piperazin-4-ium-1-yl]-1H-pyrazolo[3,4-d]pyrimidine Traditional Name: 4-[4-(4-pyridylmethyl)piperazin-4-ium-1-yl]-1H-pyrazolo[3,4-d]pyrimidine Formula: C15H18N7+ MolecularWeight: 296.35032

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=NC=C2)C3=NC=NC4=C3C=NN4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=NC=C2)C3=NC=NC4=C3C=NN4

InChI

InChI=1S/C15H17N7/c1-3-16-4-2-12(1)10-21-5-7-22(8-6-21)15-13-9-19-20-14(13)17-11-18-15/h1-4,9,11H,5-8,10H2,(H,17,18,19,20)/p+1