1-(3,5-dinitropyridin-1-ium-2-yl)azetidine-3-carboxylate

Systemtic Name: 1-(3,5-dinitropyridin-1-ium-2-yl)azetidine-3-carboxylate Openeye Name: 1-(3,5-dinitropyridin-1-ium-2-yl)azetidine-3-carboxylate CAS Name: 1-(3,5-dinitro-2-pyridin-1-iumyl)-3-azetidinecarboxylate IUPAC Name: 1-(3,5-dinitropyridin-1-ium-2-yl)azetidine-3-carboxylate Traditional Name: 1-(3,5-dinitropyridin-1-ium-2-yl)azetidine-3-carboxylate Formula: C9H8N4O6 MolecularWeight: 268.18302

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CN1C2=C(C=C(C=[NH+]2)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-]

Isomeric SMILES

C1C(CN1C2=C(C=C(C=[NH+]2)[N+](=O)[O-])[N+](=O)[O-])C(=O)[O-]

InChI

InChI=1S/C9H8N4O6/c14-9(15)5-3-11(4-5)8-7(13(18)19)1-6(2-10-8)12(16)17/h1-2,5H,3-4H2,(H,14,15)