1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine

Systemtic Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Openeye Name: 1-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine CAS Name: 1-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-N-(4-methyl-1-piperazin-4-iumyl)methanimine IUPAC Name: 1-(3,5-dimethyl-1-phenylpyrazol-4-yl)-N-(4-methylpiperazin-4-ium-1-yl)methanimine Traditional Name: (Z)-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)methylene-(4-methylpiperazin-4-ium-1-yl)amine Formula: C17H24N5+ MolecularWeight: 298.40596

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C2=CC=CC=C2)C)C=NN3CC[NH+](CC3)C

Isomeric SMILES

CC1=C(C(=NN1C2=CC=CC=C2)C)/C=N\N3CC[NH+](CC3)C

InChI

InChI=1S/C17H23N5/c1-14-17(13-18-21-11-9-20(3)10-12-21)15(2)22(19-14)16-7-5-4-6-8-16/h4-8,13H,9-12H2,1-3H3/p+1/b18-13-