1-[3-(1H-pyrazol-4-yl)propyl]-4-(pyridin-2-ylmethyl)piperazin-1-ium

Systemtic Name: 1-[3-(1H-pyrazol-4-yl)propyl]-4-(pyridin-2-ylmethyl)piperazin-1-ium Openeye Name: 1-[3-(1H-pyrazol-4-yl)propyl]-4-(2-pyridylmethyl)piperazin-1-ium CAS Name: 1-[3-(1H-pyrazol-4-yl)propyl]-4-(2-pyridinylmethyl)piperazin-1-ium IUPAC Name: 1-[3-(1H-pyrazol-4-yl)propyl]-4-(pyridin-2-ylmethyl)piperazin-1-ium Traditional Name: 1-[3-(1H-pyrazol-4-yl)propyl]-4-(2-pyridylmethyl)piperazin-1-ium Formula: C16H24N5+ MolecularWeight: 286.39526

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCCC2=CNN=C2)CC3=CC=CC=N3

Isomeric SMILES

C1CN(CC[NH+]1CCCC2=CNN=C2)CC3=CC=CC=N3

InChI

InChI=1S/C16H23N5/c1-2-6-17-16(5-1)14-21-10-8-20(9-11-21)7-3-4-15-12-18-19-13-15/h1-2,5-6,12-13H,3-4,7-11,14H2,(H,18,19)/p+1