2-methyl-2-(4-pyridin-1-ium-4-ylpyridin-1-ium-1-yl)propanedioic acid dichloride

Systemtic Name: 2-methyl-2-(4-pyridin-1-ium-4-ylpyridin-1-ium-1-yl)propanedioic acid dichloride Openeye Name: 2-methyl-2-(4-pyridin-1-ium-4-ylpyridin-1-ium-1-yl)propanedioic acid dichloride CAS Name: 2-methyl-2-[4-(4-pyridin-1-iumyl)-1-pyridin-1-iumyl]propanedioic acid dichloride IUPAC Name: 2-methyl-2-(4-pyridin-1-ium-4-ylpyridin-1-ium-1-yl)propanedioic acid dichloride Traditional Name: 2-methyl-2-(4-pyridin-1-ium-4-ylpyridin-1-ium-1-yl)malonic acid dichloride Formula: C14H14Cl2N2O4 MolecularWeight: 345.17796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)(C(=O)O)[N+]1=CC=C(C=C1)C2=CC=[NH+]C=C2.[Cl-].[Cl-]

Isomeric SMILES

CC(C(=O)O)(C(=O)O)[N+]1=CC=C(C=C1)C2=CC=[NH+]C=C2.[Cl-].[Cl-]

InChI

InChI=1S/C14H12N2O4.2ClH/c1-14(12(17)18,13(19)20)16-8-4-11(5-9-16)10-2-6-15-7-3-10;;/h2-9H,1H3,(H-,17,18,19,20);2*1H