2-(2-chloranyl-4-fluoranyl-phenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)ethanone

Systemtic Name: 2-(2-chloranyl-4-fluoranyl-phenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)ethanone Openeye Name: 1-(4-allylpiperazin-4-ium-1-yl)-2-(2-chloro-4-fluoro-phenoxy)ethanone CAS Name: 2-(2-chloro-4-fluorophenoxy)-1-(4-prop-2-enyl-1-piperazin-4-iumyl)ethanone IUPAC Name: 2-(2-chloro-4-fluorophenoxy)-1-(4-prop-2-enylpiperazin-4-ium-1-yl)ethanone Traditional Name: 1-(4-allylpiperazin-4-ium-1-yl)-2-(2-chloro-4-fluoro-phenoxy)ethanone Formula: C15H19ClFN2O2+ MolecularWeight: 313.774963

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Descriptors Computed from Structure

Canonical SMILES:

C=CC[NH+]1CCN(CC1)C(=O)COC2=C(C=C(C=C2)F)Cl

Isomeric SMILES

C=CC[NH+]1CCN(CC1)C(=O)COC2=C(C=C(C=C2)F)Cl

InChI

InChI=1S/C15H18ClFN2O2/c1-2-5-18-6-8-19(9-7-18)15(20)11-21-14-4-3-12(17)10-13(14)16/h2-4,10H,1,5-9,11H2/p+1