1-(3-nitropyridin-1-ium-2-yl)-1,4-diazepan-4-ium

Systemtic Name: 1-(3-nitropyridin-1-ium-2-yl)-1,4-diazepan-4-ium Openeye Name: 1-(3-nitropyridin-1-ium-2-yl)-1,4-diazepan-4-ium CAS Name: 1-(3-nitro-2-pyridin-1-iumyl)-1,4-diazepan-4-ium IUPAC Name: 1-(3-nitropyridin-1-ium-2-yl)-1,4-diazepan-4-ium Traditional Name: 1-(3-nitropyridin-1-ium-2-yl)-1,4-diazepan-4-ium Formula: C10H16N4O2+2 MolecularWeight: 224.25964

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C2=C(C=CC=[NH+]2)[N+](=O)[O-]

Isomeric SMILES

C1C[NH2+]CCN(C1)C2=C(C=CC=[NH+]2)[N+](=O)[O-]

InChI

InChI=1S/C10H14N4O2/c15-14(16)9-3-1-5-12-10(9)13-7-2-4-11-6-8-13/h1,3,5,11H,2,4,6-8H2/p+2