1-pyridin-2-ylethenesulfonic acid; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: 1-pyridin-2-ylethenesulfonic acid; 2-(trimethylazaniumyl)ethanoate Openeye Name: 1-(2-pyridyl)ethenesulfonic acid; 2-(trimethylammonio)acetate CAS Name: 1-(2-pyridinyl)ethenesulfonic acid; 2-(trimethylammonio)acetate IUPAC Name: 1-pyridin-2-ylethenesulfonic acid; 2-(trimethylazaniumyl)acetate Traditional Name: 1-(2-pyridyl)ethenesulfonic acid; 2-(trimethylammonio)acetate Formula: C12H18N2O5S MolecularWeight: 302.34672

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(=O)[O-].C=C(C1=CC=CC=N1)S(=O)(=O)O

Isomeric SMILES

C[N+](C)(C)CC(=O)[O-].C=C(C1=CC=CC=N1)S(=O)(=O)O

InChI

InChI=1S/C7H7NO3S.C5H11NO2/c1-6(12(9,10)11)7-4-2-3-5-8-7;1-6(2,3)4-5(7)8/h2-5H,1H2,(H,9,10,11);4H2,1-3H3