2-(1-methylpyridin-1-ium-3-yl)carbonyloxyethanesulfonate

Systemtic Name: 2-(1-methylpyridin-1-ium-3-yl)carbonyloxyethanesulfonate Openeye Name: 2-(1-methylpyridin-1-ium-3-carbonyl)oxyethanesulfonate CAS Name: 2-[(1-methyl-3-pyridin-1-iumyl)-oxomethoxy]ethanesulfonate IUPAC Name: 2-(1-methylpyridin-1-ium-3-carbonyl)oxyethanesulfonate Traditional Name: 2-(1-methylpyridin-1-ium-3-carbonyl)oxyethanesulfonate Formula: C9H11NO5S MolecularWeight: 245.25234

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC(=C1)C(=O)OCCS(=O)(=O)[O-]

Isomeric SMILES

C[N+]1=CC=CC(=C1)C(=O)OCCS(=O)(=O)[O-]

InChI

InChI=1S/C9H11NO5S/c1-10-4-2-3-8(7-10)9(11)15-5-6-16(12,13)14/h2-4,7H,5-6H2,1H3