2-pyridin-1-ium-1-ylethanesulfonic acid; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: 2-pyridin-1-ium-1-ylethanesulfonic acid; 2-(trimethylazaniumyl)ethanoate Openeye Name: 2-pyridin-1-ium-1-ylethanesulfonic acid; 2-(trimethylammonio)acetate CAS Name: 2-(1-pyridin-1-iumyl)ethanesulfonic acid; 2-(trimethylammonio)acetate IUPAC Name: 2-pyridin-1-ium-1-ylethanesulfonic acid; 2-(trimethylazaniumyl)acetate Traditional Name: 2-pyridin-1-ium-1-ylethanesulfonic acid; 2-(trimethylammonio)acetate Formula: C12H21N2O5S+ MolecularWeight: 305.37054

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H9NO3S.C5H11NO2/c9-12(10,11)7-6-8-4-2-1-3-5-8;1-6(2,3)4-5(7)8/h1-5H,6-7H2;4H2,1-3H3/p+1