1-(3-chloranylpyridin-2-yl)-4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium

Systemtic Name: 1-(3-chloranylpyridin-2-yl)-4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium Openeye Name: 1-(3-chloro-2-pyridyl)-4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium CAS Name: 1-(3-chloro-2-pyridinyl)-4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium IUPAC Name: 1-(3-chloropyridin-2-yl)-4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium Traditional Name: 1-(3-chloro-2-pyridyl)-4-[2-(1,2,4-triazol-1-yl)ethyl]piperazin-4-ium Formula: C13H18ClN6+ MolecularWeight: 293.77522

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1CCN2C=NC=N2)C3=C(C=CC=N3)Cl

Isomeric SMILES

C1CN(CC[NH+]1CCN2C=NC=N2)C3=C(C=CC=N3)Cl

InChI

InChI=1S/C13H17ClN6/c14-12-2-1-3-16-13(12)19-7-4-18(5-8-19)6-9-20-11-15-10-17-20/h1-3,10-11H,4-9H2/p+1