(3,5-dinitrophenyl)-pyridin-1-ium-1-yl-methanone chloride

Systemtic Name: (3,5-dinitrophenyl)-pyridin-1-ium-1-yl-methanone chloride Openeye Name: (3,5-dinitrophenyl)-pyridin-1-ium-1-yl-methanone chloride CAS Name: (3,5-dinitrophenyl)-(1-pyridin-1-iumyl)methanone chloride IUPAC Name: (3,5-dinitrophenyl)-pyridin-1-ium-1-ylmethanone chloride Traditional Name: (3,5-dinitrophenyl)-pyridin-1-ium-1-yl-methanone chloride Formula: C12H8ClN3O5 MolecularWeight: 309.66202

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)C(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C12H8N3O5.ClH/c16-12(13-4-2-1-3-5-13)9-6-10(14(17)18)8-11(7-9)15(19)20;/h1-8H;1H/q+1;/p-1