1-(1,2-dimethyl-5-phenyl-pyrazol-3-ylidene)-4-methyl-piperazin-1-ium

Systemtic Name: 1-(1,2-dimethyl-5-phenyl-pyrazol-3-ylidene)-4-methyl-piperazin-1-ium Openeye Name: 1-(1,2-dimethyl-5-phenyl-pyrazol-3-ylidene)-4-methyl-piperazin-1-ium CAS Name: 1-(1,2-dimethyl-5-phenyl-3-pyrazolylidene)-4-methylpiperazin-1-ium IUPAC Name: 1-(1,2-dimethyl-5-phenylpyrazol-3-ylidene)-4-methylpiperazin-1-ium Traditional Name: 1-(1,2-dimethyl-5-phenyl-3-pyrazolin-3-ylidene)-4-methyl-piperazin-1-ium Formula: C16H23N4+ MolecularWeight: 271.38062

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Descriptors Computed from Structure

Canonical SMILES:

CN1CC[N+](=C2C=C(N(N2C)C)C3=CC=CC=C3)CC1

Isomeric SMILES

CN1CC[N+](=C2C=C(N(N2C)C)C3=CC=CC=C3)CC1

InChI

InChI=1S/C16H23N4/c1-17-9-11-20(12-10-17)16-13-15(18(2)19(16)3)14-7-5-4-6-8-14/h4-8,13H,9-12H2,1-3H3/q+1