6-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]-7H-purine

Systemtic Name: 6-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]-7H-purine Openeye Name: 6-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]-7H-purine CAS Name: 6-[4-(2-pyridinylmethyl)-1-piperazin-4-iumyl]-7H-purine IUPAC Name: 6-[4-(pyridin-2-ylmethyl)piperazin-4-ium-1-yl]-7H-purine Traditional Name: 6-[4-(2-pyridylmethyl)piperazin-4-ium-1-yl]-7H-purine Formula: C15H18N7+ MolecularWeight: 296.35032

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC=N2)C3=NC=NC4=C3NC=N4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC=N2)C3=NC=NC4=C3NC=N4

InChI

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