1-(2,4-dinitrophenyl)-3,4-dimethyl-pyridin-1-ium chloride

Systemtic Name: 1-(2,4-dinitrophenyl)-3,4-dimethyl-pyridin-1-ium chloride Openeye Name: 1-(2,4-dinitrophenyl)-3,4-dimethyl-pyridin-1-ium chloride CAS Name: 1-(2,4-dinitrophenyl)-3,4-dimethylpyridin-1-ium chloride IUPAC Name: 1-(2,4-dinitrophenyl)-3,4-dimethylpyridin-1-ium chloride Traditional Name: 1-(2,4-dinitrophenyl)-3,4-dimethyl-pyridin-1-ium chloride Formula: C13H12ClN3O4 MolecularWeight: 309.70508

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=[N+](C=C1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C.[Cl-]

Isomeric SMILES

CC1=C(C=[N+](C=C1)C2=C(C=C(C=C2)[N+](=O)[O-])[N+](=O)[O-])C.[Cl-]

InChI

InChI=1S/C13H12N3O4.ClH/c1-9-5-6-14(8-10(9)2)12-4-3-11(15(17)18)7-13(12)16(19)20;/h3-8H,1-2H3;1H/q+1;/p-1