2-oxidanyl-3-pyridin-1-ium-1-yl-propane-1-sulfonic acid

Systemtic Name: 2-oxidanyl-3-pyridin-1-ium-1-yl-propane-1-sulfonic acid Openeye Name: 2-hydroxy-3-pyridin-1-ium-1-yl-propane-1-sulfonic acid CAS Name: 2-hydroxy-3-(1-pyridin-1-iumyl)-1-propanesulfonic acid IUPAC Name: 2-hydroxy-3-pyridin-1-ium-1-ylpropane-1-sulfonic acid Traditional Name: 2-hydroxy-3-pyridin-1-ium-1-yl-propane-1-sulfonic acid Formula: C8H12NO4S+ MolecularWeight: 218.25018

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=[N+](C=C1)CC(CS(=O)(=O)O)O

Isomeric SMILES

C1=CC=[N+](C=C1)CC(CS(=O)(=O)O)O

InChI

InChI=1S/C8H11NO4S/c10-8(7-14(11,12)13)6-9-4-2-1-3-5-9/h1-5,8,10H,6-7H2/p+1