1-(2-sulfonatoethyl)pyridin-1-ium-4-carboxylate

Systemtic Name: 1-(2-sulfonatoethyl)pyridin-1-ium-4-carboxylate Openeye Name: 1-(2-sulfonatoethyl)pyridin-1-ium-4-carboxylate CAS Name: 1-(2-sulfonatoethyl)-4-pyridin-1-iumcarboxylate IUPAC Name: 1-(2-sulfonatoethyl)pyridin-1-ium-4-carboxylate Traditional Name: 1-(2-sulfonatoethyl)pyridin-1-ium-4-carboxylate Formula: C8H8NO5S- MolecularWeight: 230.21782

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Descriptors Computed from Structure

Canonical SMILES:

C1=C[N+](=CC=C1C(=O)[O-])CCS(=O)(=O)[O-]

Isomeric SMILES

C1=C[N+](=CC=C1C(=O)[O-])CCS(=O)(=O)[O-]

InChI

InChI=1S/C8H9NO5S/c10-8(11)7-1-3-9(4-2-7)5-6-15(12,13)14/h1-4H,5-6H2,(H-,10,11,12,13,14)/p-1