(4-ethylpiperazin-4-ium-1-yl)-[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methanone

Systemtic Name: (4-ethylpiperazin-4-ium-1-yl)-[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methanone Openeye Name: (4-ethylpiperazin-4-ium-1-yl)-[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methanone CAS Name: (4-ethyl-1-piperazin-4-iumyl)-[3-(3-methoxyphenyl)-1-phenyl-4-pyrazolyl]methanone IUPAC Name: (4-ethylpiperazin-4-ium-1-yl)-[3-(3-methoxyphenyl)-1-phenylpyrazol-4-yl]methanone Traditional Name: (4-ethylpiperazin-4-ium-1-yl)-[3-(3-methoxyphenyl)-1-phenyl-pyrazol-4-yl]methanone Formula: C23H27N4O2+ MolecularWeight: 391.48608

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C(=O)C2=CN(N=C2C3=CC(=CC=C3)OC)C4=CC=CC=C4

Isomeric SMILES

CC[NH+]1CCN(CC1)C(=O)C2=CN(N=C2C3=CC(=CC=C3)OC)C4=CC=CC=C4

InChI

InChI=1S/C23H26N4O2/c1-3-25-12-14-26(15-13-25)23(28)21-17-27(19-9-5-4-6-10-19)24-22(21)18-8-7-11-20(16-18)29-2/h4-11,16-17H,3,12-15H2,1-2H3/p+1