1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-[2,4,5-tris(chloranyl)phenoxy]ethanone

Systemtic Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-[2,4,5-tris(chloranyl)phenoxy]ethanone Openeye Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(2,4,5-trichlorophenoxy)ethanone CAS Name: 1-[4-(2-pyrimidinyl)-1-piperazinyl]-2-(2,4,5-trichlorophenoxy)ethanone IUPAC Name: 1-(4-pyrimidin-2-ylpiperazin-1-yl)-2-(2,4,5-trichlorophenoxy)ethanone Traditional Name: 1-[4-(2-pyrimidyl)piperazino]-2-(2,4,5-trichlorophenoxy)ethanone Formula: C16H15Cl3N4O2 MolecularWeight: 401.6749

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=NC=CC=N2)C(=O)COC3=CC(=C(C=C3Cl)Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=NC=CC=N2)C(=O)COC3=CC(=C(C=C3Cl)Cl)Cl

InChI

InChI=1S/C16H15Cl3N4O2/c17-11-8-13(19)14(9-12(11)18)25-10-15(24)22-4-6-23(7-5-22)16-20-2-1-3-21-16/h1-3,8-9H,4-7,10H2