2,2,2-tris(chloranyl)-1-[4-(2-methoxy-5-nitro-phenyl)piperazin-1-yl]ethanone

Systemtic Name: 2,2,2-tris(chloranyl)-1-[4-(2-methoxy-5-nitro-phenyl)piperazin-1-yl]ethanone Openeye Name: 2,2,2-trichloro-1-[4-(2-methoxy-5-nitro-phenyl)piperazin-1-yl]ethanone CAS Name: 2,2,2-trichloro-1-[4-(2-methoxy-5-nitrophenyl)-1-piperazinyl]ethanone IUPAC Name: 2,2,2-trichloro-1-[4-(2-methoxy-5-nitrophenyl)piperazin-1-yl]ethanone Traditional Name: 2,2,2-trichloro-1-[4-(2-methoxy-5-nitro-phenyl)piperazino]ethanone Formula: C13H14Cl3N3O4 MolecularWeight: 382.62696

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])N2CCN(CC2)C(=O)C(Cl)(Cl)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])N2CCN(CC2)C(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C13H14Cl3N3O4/c1-23-11-3-2-9(19(21)22)8-10(11)17-4-6-18(7-5-17)12(20)13(14,15)16/h2-3,8H,4-7H2,1H3