2-[4-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine

Systemtic Name: 2-[4-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine Openeye Name: 2-[4-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine CAS Name: 2-[4-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]-1-piperazin-4-iumyl]pyrazine IUPAC Name: 2-[4-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine Traditional Name: 2-[4-[[5-(1,3-benzodioxol-5-yl)-1H-pyrazol-4-yl]methyl]piperazin-4-ium-1-yl]pyrazine Formula: C19H21N6O2+ MolecularWeight: 365.40904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CC2=C(NN=C2)C3=CC4=C(C=C3)OCO4)C5=NC=CN=C5

Isomeric SMILES

C1CN(CC[NH+]1CC2=C(NN=C2)C3=CC4=C(C=C3)OCO4)C5=NC=CN=C5

InChI

InChI=1S/C19H20N6O2/c1-2-16-17(27-13-26-16)9-14(1)19-15(10-22-23-19)12-24-5-7-25(8-6-24)18-11-20-3-4-21-18/h1-4,9-11H,5-8,12-13H2,(H,22,23)/p+1