2-[1-[2-(3-methylpyridin-1-ium-1-yl)ethyl]pyridin-1-ium-4-yl]ethanesulfonate

Systemtic Name: 2-[1-[2-(3-methylpyridin-1-ium-1-yl)ethyl]pyridin-1-ium-4-yl]ethanesulfonate Openeye Name: 2-[1-[2-(3-methylpyridin-1-ium-1-yl)ethyl]pyridin-1-ium-4-yl]ethanesulfonate CAS Name: 2-[1-[2-(3-methyl-1-pyridin-1-iumyl)ethyl]-4-pyridin-1-iumyl]ethanesulfonate IUPAC Name: 2-[1-[2-(3-methylpyridin-1-ium-1-yl)ethyl]pyridin-1-ium-4-yl]ethanesulfonate Traditional Name: 2-[1-[2-(3-methylpyridin-1-ium-1-yl)ethyl]pyridin-1-ium-4-yl]ethanesulfonate Formula: C15H19N2O3S+ MolecularWeight: 307.38796

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C[N+](=CC=C1)CC[N+]2=CC=C(C=C2)CCS(=O)(=O)[O-]

Isomeric SMILES

CC1=C[N+](=CC=C1)CC[N+]2=CC=C(C=C2)CCS(=O)(=O)[O-]

InChI

InChI=1S/C15H19N2O3S/c1-14-3-2-7-17(13-14)11-10-16-8-4-15(5-9-16)6-12-21(18,19)20/h2-5,7-9,13H,6,10-12H2,1H3/q+1