1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-4-ium

Systemtic Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-4-ium Openeye Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-4-ium CAS Name: 1-[(3,5-dimethyl-1-phenyl-4-pyrazolyl)methyl]piperazin-4-ium IUPAC Name: 1-[(3,5-dimethyl-1-phenylpyrazol-4-yl)methyl]piperazin-4-ium Traditional Name: 1-[(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methyl]piperazin-4-ium Formula: C16H23N4+ MolecularWeight: 271.38062

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)CN3CC[NH2+]CC3

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)CN3CC[NH2+]CC3

InChI

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