2-[[2-(1,3-dioxolan-2-yl)-2H-pyridin-1-yl]methyl]benzenesulfonic acid

Systemtic Name: 2-[[2-(1,3-dioxolan-2-yl)-2H-pyridin-1-yl]methyl]benzenesulfonic acid Openeye Name: 2-[[2-(1,3-dioxolan-2-yl)-2H-pyridin-1-yl]methyl]benzenesulfonic acid CAS Name: 2-[[2-(1,3-dioxolan-2-yl)-2H-pyridin-1-yl]methyl]benzenesulfonic acid IUPAC Name: 2-[[2-(1,3-dioxolan-2-yl)-2H-pyridin-1-yl]methyl]benzenesulfonic acid Traditional Name: 2-[[2-(1,3-dioxolan-2-yl)-2H-pyridin-1-yl]methyl]besylic acid Formula: C15H17NO5S MolecularWeight: 323.36418

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Descriptors Computed from Structure

Canonical SMILES:

C1COC(O1)C2C=CC=CN2CC3=CC=CC=C3S(=O)(=O)O

Isomeric SMILES

C1COC(O1)C2C=CC=CN2CC3=CC=CC=C3S(=O)(=O)O

InChI

InChI=1S/C15H17NO5S/c17-22(18,19)14-7-2-1-5-12(14)11-16-8-4-3-6-13(16)15-20-9-10-21-15/h1-8,13,15H,9-11H2,(H,17,18,19)