1-methyl-4-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium

Systemtic Name: 1-methyl-4-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium Openeye Name: 1-methyl-4-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium CAS Name: 1-methyl-4-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium IUPAC Name: 1-methyl-4-[[5-(4-methylphenyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium Traditional Name: 1-methyl-4-[[5-(p-tolyl)-1H-pyrazol-4-yl]methyl]piperazin-1-ium Formula: C16H23N4+ MolecularWeight: 271.38062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(C=NN2)CN3CC[NH+](CC3)C

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(C=NN2)CN3CC[NH+](CC3)C

InChI

InChI=1S/C16H22N4/c1-13-3-5-14(6-4-13)16-15(11-17-18-16)12-20-9-7-19(2)8-10-20/h3-6,11H,7-10,12H2,1-2H3,(H,17,18)/p+1