1-ethyl-4-(5-nitropyridin-1-ium-2-yl)piperazin-1-ium

Systemtic Name: 1-ethyl-4-(5-nitropyridin-1-ium-2-yl)piperazin-1-ium Openeye Name: 1-ethyl-4-(5-nitropyridin-1-ium-2-yl)piperazin-1-ium CAS Name: 1-ethyl-4-(5-nitro-2-pyridin-1-iumyl)piperazin-1-ium IUPAC Name: 1-ethyl-4-(5-nitropyridin-1-ium-2-yl)piperazin-1-ium Traditional Name: 1-ethyl-4-(5-nitropyridin-1-ium-2-yl)piperazin-1-ium Formula: C11H18N4O2+2 MolecularWeight: 238.28622

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCN(CC1)C2=[NH+]C=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCN(CC1)C2=[NH+]C=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C11H16N4O2/c1-2-13-5-7-14(8-6-13)11-4-3-10(9-12-11)15(16)17/h3-4,9H,2,5-8H2,1H3/p+2