1-(5-chloranylpyridin-2-yl)-4-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]piperazin-4-ium

Systemtic Name: 1-(5-chloranylpyridin-2-yl)-4-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]piperazin-4-ium Openeye Name: 1-(5-chloro-2-pyridyl)-4-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]piperazin-4-ium CAS Name: 1-(5-chloro-2-pyridinyl)-4-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]piperazin-4-ium IUPAC Name: 1-(5-chloropyridin-2-yl)-4-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]piperazin-4-ium Traditional Name: 1-(5-chloro-2-pyridyl)-4-[(3-ethyl-4-methyl-1H-pyrazol-5-yl)methyl]piperazin-4-ium Formula: C16H23ClN5+ MolecularWeight: 320.84032

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NNC(=C1C)C[NH+]2CCN(CC2)C3=NC=C(C=C3)Cl

Isomeric SMILES

CCC1=NNC(=C1C)C[NH+]2CCN(CC2)C3=NC=C(C=C3)Cl

InChI

InChI=1S/C16H22ClN5/c1-3-14-12(2)15(20-19-14)11-21-6-8-22(9-7-21)16-5-4-13(17)10-18-16/h4-5,10H,3,6-9,11H2,1-2H3,(H,19,20)/p+1