1-(4-methylpiperazin-4-ium-1-yl)-2-[2,4,5-tris(chloranyl)phenoxy]ethanone

Systemtic Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-[2,4,5-tris(chloranyl)phenoxy]ethanone Openeye Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(2,4,5-trichlorophenoxy)ethanone CAS Name: 1-(4-methyl-1-piperazin-4-iumyl)-2-(2,4,5-trichlorophenoxy)ethanone IUPAC Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(2,4,5-trichlorophenoxy)ethanone Traditional Name: 1-(4-methylpiperazin-4-ium-1-yl)-2-(2,4,5-trichlorophenoxy)ethanone Formula: C13H16Cl3N2O2+ MolecularWeight: 338.63734

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C(=O)COC2=CC(=C(C=C2Cl)Cl)Cl

Isomeric SMILES

C[NH+]1CCN(CC1)C(=O)COC2=CC(=C(C=C2Cl)Cl)Cl

InChI

InChI=1S/C13H15Cl3N2O2/c1-17-2-4-18(5-3-17)13(19)8-20-12-7-10(15)9(14)6-11(12)16/h6-7H,2-5,8H2,1H3/p+1