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

Systemtic Name: 2,2-bis(chloranyl)-1-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]ethanone Openeye Name: 2,2-dichloro-1-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]ethanone CAS Name: 2,2-dichloro-1-[4-(5-nitro-2-pyridin-1-iumyl)-1-piperazinyl]ethanone IUPAC Name: 2,2-dichloro-1-[4-(5-nitropyridin-1-ium-2-yl)piperazin-1-yl]ethanone Traditional Name: 2,2-dichloro-1-[4-(5-nitropyridin-1-ium-2-yl)piperazino]ethanone Formula: C11H13Cl2N4O3+ MolecularWeight: 320.15192

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H12Cl2N4O3/c12-10(13)11(18)16-5-3-15(4-6-16)9-2-1-8(7-14-9)17(19)20/h1-2,7,10H,3-6H2/p+1