4-methyl-1-[(4-methylpyridin-1-ium-1-yl)methyl]pyridin-1-ium iodide

Systemtic Name: 4-methyl-1-[(4-methylpyridin-1-ium-1-yl)methyl]pyridin-1-ium iodide Openeye Name: 4-methyl-1-[(4-methylpyridin-1-ium-1-yl)methyl]pyridin-1-ium iodide CAS Name: 4-methyl-1-[(4-methyl-1-pyridin-1-iumyl)methyl]pyridin-1-ium iodide IUPAC Name: 4-methyl-1-[(4-methylpyridin-1-ium-1-yl)methyl]pyridin-1-ium iodide Traditional Name: 4-methyl-1-[(4-methylpyridin-1-ium-1-yl)methyl]pyridin-1-ium iodide Formula: C13H16IN2+ MolecularWeight: 327.18401

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=[N+](C=C1)C[N+]2=CC=C(C=C2)C.[I-]

Isomeric SMILES

CC1=CC=[N+](C=C1)C[N+]2=CC=C(C=C2)C.[I-]

InChI

InChI=1S/C13H16N2.HI/c1-12-3-7-14(8-4-12)11-15-9-5-13(2)6-10-15;/h3-10H,11H2,1-2H3;1H/q+2;/p-1