1-[(2,4-dinitrophenyl)methyl]pyridin-1-ium chloride

Systemtic Name: 1-[(2,4-dinitrophenyl)methyl]pyridin-1-ium chloride Openeye Name: 1-[(2,4-dinitrophenyl)methyl]pyridin-1-ium chloride CAS Name: 1-[(2,4-dinitrophenyl)methyl]pyridin-1-ium chloride IUPAC Name: 1-[(2,4-dinitrophenyl)methyl]pyridin-1-ium chloride Traditional Name: 1-(2,4-dinitrobenzyl)pyridin-1-ium chloride Formula: C12H10ClN3O4 MolecularWeight: 295.6785

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-].[Cl-]

Isomeric SMILES

C1=CC=[N+](C=C1)CC2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-].[Cl-]

InChI

InChI=1S/C12H10N3O4.ClH/c16-14(17)11-5-4-10(12(8-11)15(18)19)9-13-6-2-1-3-7-13;/h1-8H,9H2;1H/q+1;/p-1