2,3,4,5,6-pentadeuterio-1-(2,4-dinitrophenyl)pyridin-1-ium chloride

Systemtic Name: 2,3,4,5,6-pentadeuterio-1-(2,4-dinitrophenyl)pyridin-1-ium chloride Openeye Name: 2,3,4,5,6-pentadeuterio-1-(2,4-dinitrophenyl)pyridin-1-ium chloride CAS Name: 2,3,4,5,6-pentadeuterio-1-(2,4-dinitrophenyl)pyridin-1-ium chloride IUPAC Name: 2,3,4,5,6-pentadeuterio-1-(2,4-dinitrophenyl)pyridin-1-ium chloride Traditional Name: 2,3,4,5,6-pentadeuterio-1-(2,4-dinitrophenyl)pyridin-1-ium chloride Formula: C11H8ClN3O4 MolecularWeight: 286.682729

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H8N3O4.ClH/c15-13(16)9-4-5-10(11(8-9)14(17)18)12-6-2-1-3-7-12;/h1-8H;1H/q+1;/p-1/i1D,2D,3D,6D,7D;