2-[4-[[3-(1H-pyrazol-4-yl)phenyl]methyl]piperazin-4-ium-1-yl]pyrazine

Systemtic Name: 2-[4-[[3-(1H-pyrazol-4-yl)phenyl]methyl]piperazin-4-ium-1-yl]pyrazine Openeye Name: 2-[4-[[3-(1H-pyrazol-4-yl)phenyl]methyl]piperazin-4-ium-1-yl]pyrazine CAS Name: 2-[4-[[3-(1H-pyrazol-4-yl)phenyl]methyl]-1-piperazin-4-iumyl]pyrazine IUPAC Name: 2-[4-[[3-(1H-pyrazol-4-yl)phenyl]methyl]piperazin-4-ium-1-yl]pyrazine Traditional Name: 2-[4-[3-(1H-pyrazol-4-yl)benzyl]piperazin-4-ium-1-yl]pyrazine Formula: C18H21N6+ MolecularWeight: 321.39954

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=CC=CC(=C2)C3=CNN=C3)C4=NC=CN=C4

Isomeric SMILES

C1CN(CC[NH+]1CC2=CC=CC(=C2)C3=CNN=C3)C4=NC=CN=C4

InChI

InChI=1S/C18H20N6/c1-2-15(10-16(3-1)17-11-21-22-12-17)14-23-6-8-24(9-7-23)18-13-19-4-5-20-18/h1-5,10-13H,6-9,14H2,(H,21,22)/p+1