(2S)-4-methyl-1-[(2-methylpyrazol-3-yl)methyl]-2-phenyl-piperazin-4-ium

Systemtic Name: (2S)-4-methyl-1-[(2-methylpyrazol-3-yl)methyl]-2-phenyl-piperazin-4-ium Openeye Name: (2S)-4-methyl-1-[(2-methylpyrazol-3-yl)methyl]-2-phenyl-piperazin-4-ium CAS Name: (2S)-4-methyl-1-[(2-methyl-3-pyrazolyl)methyl]-2-phenylpiperazin-4-ium IUPAC Name: (2S)-4-methyl-1-[(2-methylpyrazol-3-yl)methyl]-2-phenylpiperazin-4-ium Traditional Name: (2S)-4-methyl-1-[(2-methylpyrazol-3-yl)methyl]-2-phenyl-piperazin-4-ium Formula: C16H23N4+ MolecularWeight: 271.38062

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(C(C1)C2=CC=CC=C2)CC3=CC=NN3C

Isomeric SMILES

C[NH+]1CCN([C@H](C1)C2=CC=CC=C2)CC3=CC=NN3C

InChI

InChI=1S/C16H22N4/c1-18-10-11-20(12-15-8-9-17-19(15)2)16(13-18)14-6-4-3-5-7-14/h3-9,16H,10-13H2,1-2H3/p+1/t16-/m1/s1