2,2,2-tris(chloranyl)-1-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]ethanone

Systemtic Name: 2,2,2-tris(chloranyl)-1-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]ethanone Openeye Name: 2,2,2-trichloro-1-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]ethanone CAS Name: 2,2,2-trichloro-1-[4-(5-nitro-2-pyridin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2,2,2-trichloro-1-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]ethanone Traditional Name: 2,2,2-trichloro-1-[4-(5-nitropyridin-1-ium-2-yl)piperazino]ethanone Formula: C11H12Cl3N4O3+ MolecularWeight: 354.59698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=[NH+]C=C(C=C2)[N+](=O)[O-])C(=O)C(Cl)(Cl)Cl

Isomeric SMILES

C1CN(CCN1C2=[NH+]C=C(C=C2)[N+](=O)[O-])C(=O)C(Cl)(Cl)Cl

InChI

InChI=1S/C11H11Cl3N4O3/c12-11(13,14)10(19)17-5-3-16(4-6-17)9-2-1-8(7-15-9)18(20)21/h1-2,7H,3-6H2/p+1