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

Systemtic Name: [2-(3-chlorophenyl)-5-(3-methoxyphenyl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Openeye Name: [2-(3-chlorophenyl)-5-(3-methoxyphenyl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone CAS Name: [2-(3-chlorophenyl)-5-(3-methoxyphenyl)-3-pyrazolyl]-(4-ethyl-1-piperazin-4-iumyl)methanone IUPAC Name: [2-(3-chlorophenyl)-5-(3-methoxyphenyl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Traditional Name: [2-(3-chlorophenyl)-5-(3-methoxyphenyl)pyrazol-3-yl]-(4-ethylpiperazin-4-ium-1-yl)methanone Formula: C23H26ClN4O2+ MolecularWeight: 425.93114

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H25ClN4O2/c1-3-26-10-12-27(13-11-26)23(29)22-16-21(17-6-4-9-20(14-17)30-2)25-28(22)19-8-5-7-18(24)15-19/h4-9,14-16H,3,10-13H2,1-2H3/p+1