[1,1-dimethyl-4-(methylsulfonylmethyl)pyrrolidin-1-ium-3-yl]methanesulfonic acid; 2-(trimethylazaniumyl)ethanoate

Systemtic Name: [1,1-dimethyl-4-(methylsulfonylmethyl)pyrrolidin-1-ium-3-yl]methanesulfonic acid; 2-(trimethylazaniumyl)ethanoate Openeye Name: [1,1-dimethyl-4-(methylsulfonylmethyl)pyrrolidin-1-ium-3-yl]methanesulfonic acid; 2-(trimethylammonio)acetate CAS Name: [1,1-dimethyl-4-(methylsulfonylmethyl)-3-pyrrolidin-1-iumyl]methanesulfonic acid; 2-(trimethylammonio)acetate IUPAC Name: [1,1-dimethyl-4-(methylsulfonylmethyl)pyrrolidin-1-ium-3-yl]methanesulfonic acid; 2-(trimethylazaniumyl)acetate Traditional Name: [4-(mesylmethyl)-1,1-dimethyl-pyrrolidin-1-ium-3-yl]methanesulfonic acid; 2-(trimethylammonio)acetate Formula: C14H31N2O7S2+ MolecularWeight: 403.53514

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1(CC(C(C1)CS(=O)(=O)O)CS(=O)(=O)C)C.C[N+](C)(C)CC(=O)[O-]

Isomeric SMILES

C[N+]1(CC(C(C1)CS(=O)(=O)O)CS(=O)(=O)C)C.C[N+](C)(C)CC(=O)[O-]

InChI

InChI=1S/C9H19NO5S2.C5H11NO2/c1-10(2)4-8(6-16(3,11)12)9(5-10)7-17(13,14)15;1-6(2,3)4-5(7)8/h8-9H,4-7H2,1-3H3;4H2,1-3H3/p+1