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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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