1-pyridin-1-ium-1-ylpropane-1-sulfonic acid

Systemtic Name: 1-pyridin-1-ium-1-ylpropane-1-sulfonic acid Openeye Name: 1-pyridin-1-ium-1-ylpropane-1-sulfonic acid CAS Name: 1-(1-pyridin-1-iumyl)-1-propanesulfonic acid IUPAC Name: 1-pyridin-1-ium-1-ylpropane-1-sulfonic acid Traditional Name: 1-pyridin-1-ium-1-ylpropane-1-sulfonic acid Formula: C8H12NO3S+ MolecularWeight: 202.25078

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Descriptors Computed from Structure

Canonical SMILES:

CCC([N+]1=CC=CC=C1)S(=O)(=O)O

Isomeric SMILES

CCC([N+]1=CC=CC=C1)S(=O)(=O)O

InChI

InChI=1S/C8H11NO3S/c1-2-8(13(10,11)12)9-6-4-3-5-7-9/h3-8H,2H2,1H3/p+1