[2-[4-(trioxidanylsulfanylmethyl)pyridin-2-yl]pyridin-4-yl]methanesulfonic acid

Systemtic Name: [2-[4-(trioxidanylsulfanylmethyl)pyridin-2-yl]pyridin-4-yl]methanesulfonic acid Openeye Name: [2-[4-(trioxidanylsulfanylmethyl)-2-pyridyl]-4-pyridyl]methanesulfonic acid CAS Name: [2-[4-[(trioxidanylthio)methyl]-2-pyridinyl]-4-pyridinyl]methanesulfonic acid IUPAC Name: [2-[4-(trioxidanylsulfanylmethyl)pyridin-2-yl]pyridin-4-yl]methanesulfonic acid Traditional Name: [2-[4-[(trioxidanylthio)methyl]-2-pyridyl]-4-pyridyl]methanesulfonic acid Formula: C12H12N2O6S2 MolecularWeight: 344.36348

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(C=C1CSOOO)C2=NC=CC(=C2)CS(=O)(=O)O

Isomeric SMILES

C1=CN=C(C=C1CSOOO)C2=NC=CC(=C2)CS(=O)(=O)O

InChI

InChI=1S/C12H12N2O6S2/c15-19-20-21-7-9-1-3-13-11(5-9)12-6-10(2-4-14-12)8-22(16,17)18/h1-6,15H,7-8H2,(H,16,17,18)