2-[[2-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate

Systemtic Name: 2-[[2-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate Openeye Name: 2-[[2-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate CAS Name: 2-[[2-(2-methyl-1,3-dioxolan-2-yl)-1-pyridin-1-iumyl]methyl]benzenesulfonate IUPAC Name: 2-[[2-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]benzenesulfonate Traditional Name: 2-[[2-(2-methyl-1,3-dioxolan-2-yl)pyridin-1-ium-1-yl]methyl]besylate Formula: C16H17NO5S MolecularWeight: 335.37488

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Descriptors Computed from Structure

Canonical SMILES:

CC1(OCCO1)C2=CC=CC=[N+]2CC3=CC=CC=C3S(=O)(=O)[O-]

Isomeric SMILES

CC1(OCCO1)C2=CC=CC=[N+]2CC3=CC=CC=C3S(=O)(=O)[O-]

InChI

InChI=1S/C16H17NO5S/c1-16(21-10-11-22-16)15-8-4-5-9-17(15)12-13-6-2-3-7-14(13)23(18,19)20/h2-9H,10-12H2,1H3