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

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(3-methylphenyl)-5-phenyl-pyrazol-3-yl]methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(m-tolyl)-5-phenyl-pyrazol-3-yl]methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[2-(3-methylphenyl)-5-phenyl-3-pyrazolyl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(3-methylphenyl)-5-phenylpyrazol-3-yl]methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(m-tolyl)-5-phenyl-pyrazol-3-yl]methanone Formula: C23H27N4O+ MolecularWeight: 375.48668

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC(=C3)C)C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CC(=NN2C3=CC=CC(=C3)C)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O/c1-3-25-12-14-26(15-13-25)23(28)22-17-21(19-9-5-4-6-10-19)24-27(22)20-11-7-8-18(2)16-20/h4-11,16-17H,3,12-15H2,1-2H3/p+1