(4-ethylpiperazin-4-ium-1-yl)-[2-(4-fluorophenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(4-fluorophenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(4-fluorophenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[2-(4-fluorophenyl)-5-(4-methoxyphenyl)-3-pyrazolyl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(4-fluorophenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[2-(4-fluorophenyl)-5-(4-methoxyphenyl)pyrazol-3-yl]methanone Formula: C23H26FN4O2+ MolecularWeight: 409.476543

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25FN4O2/c1-3-26-12-14-27(15-13-26)23(29)22-16-21(17-4-10-20(30-2)11-5-17)25-28(22)19-8-6-18(24)7-9-19/h4-11,16H,3,12-15H2,1-2H3/p+1