N-(1-ethylpiperidin-1-ium-4-yl)-3-nitro-pyridin-1-ium-2-amine

Systemtic Name: N-(1-ethylpiperidin-1-ium-4-yl)-3-nitro-pyridin-1-ium-2-amine Openeye Name: N-(1-ethylpiperidin-1-ium-4-yl)-3-nitro-pyridin-1-ium-2-amine CAS Name: N-(1-ethyl-4-piperidin-1-iumyl)-3-nitro-2-pyridin-1-iumamine IUPAC Name: N-(1-ethylpiperidin-1-ium-4-yl)-3-nitropyridin-1-ium-2-amine Traditional Name: (1-ethylpiperidin-1-ium-4-yl)-(3-nitropyridin-1-ium-2-yl)amine Formula: C12H20N4O2+2 MolecularWeight: 252.3128

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+]1CCC(CC1)NC2=C(C=CC=[NH+]2)[N+](=O)[O-]

Isomeric SMILES

CC[NH+]1CCC(CC1)NC2=C(C=CC=[NH+]2)[N+](=O)[O-]

InChI

InChI=1S/C12H18N4O2/c1-2-15-8-5-10(6-9-15)14-12-11(16(17)18)4-3-7-13-12/h3-4,7,10H,2,5-6,8-9H2,1H3,(H,13,14)/p+2