5-[(4-ethylpiperazin-1-yl)methyl]-2-(2-methylphenyl)-4-phenyl-1H-pyrazol-2-ium-3-amine

Systemtic Name: 5-[(4-ethylpiperazin-1-yl)methyl]-2-(2-methylphenyl)-4-phenyl-1H-pyrazol-2-ium-3-amine Openeye Name: 5-[(4-ethylpiperazin-1-yl)methyl]-2-(o-tolyl)-4-phenyl-1H-pyrazol-2-ium-3-amine CAS Name: 5-[(4-ethyl-1-piperazinyl)methyl]-2-(2-methylphenyl)-4-phenyl-1H-pyrazol-2-ium-3-amine IUPAC Name: 5-[(4-ethylpiperazin-1-yl)methyl]-2-(2-methylphenyl)-4-phenyl-1H-pyrazol-2-ium-3-amine Traditional Name: [5-[(4-ethylpiperazino)methyl]-2-(o-tolyl)-4-phenyl-1H-pyrazol-2-ium-3-yl]amine Formula: C23H30N5+ MolecularWeight: 376.5178

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC2=C(C(=[N+](N2)C3=CC=CC=C3C)N)C4=CC=CC=C4

Isomeric SMILES

CCN1CCN(CC1)CC2=C(C(=[N+](N2)C3=CC=CC=C3C)N)C4=CC=CC=C4

InChI

InChI=1S/C23H29N5/c1-3-26-13-15-27(16-14-26)17-20-22(19-10-5-4-6-11-19)23(24)28(25-20)21-12-8-7-9-18(21)2/h4-12H,3,13-17H2,1-2H3,(H2,24,25)/p+1