1-(2,4-dinitrophenyl)pyridin-1-ium-4-carbonitrile chloride

Systemtic Name: 1-(2,4-dinitrophenyl)pyridin-1-ium-4-carbonitrile chloride Openeye Name: 1-(2,4-dinitrophenyl)pyridin-1-ium-4-carbonitrile chloride CAS Name: 1-(2,4-dinitrophenyl)-4-pyridin-1-iumcarbonitrile chloride IUPAC Name: 1-(2,4-dinitrophenyl)pyridin-1-ium-4-carbonitrile chloride Traditional Name: 1-(2,4-dinitrophenyl)pyridin-1-ium-4-carbonitrile chloride Formula: C12H7ClN4O4 MolecularWeight: 306.66138

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+]2=CC=C(C=C2)C#N.[Cl-]

Isomeric SMILES

C1=CC(=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+]2=CC=C(C=C2)C#N.[Cl-]

InChI

InChI=1S/C12H7N4O4.ClH/c13-8-9-3-5-14(6-4-9)11-2-1-10(15(17)18)7-12(11)16(19)20;/h1-7H;1H/q+1;/p-1