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

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

Systemtic Name:(1,4-dimethyl-1-octyl-pyrrolidin-1-ium-3-yl)methanesulfonic acid; 2-(trimethylazaniumyl)ethanoate
Openeye Name:(1,4-dimethyl-1-octyl-pyrrolidin-1-ium-3-yl)methanesulfonic acid; 2-(trimethylammonio)acetate
CAS Name:(1,4-dimethyl-1-octyl-3-pyrrolidin-1-iumyl)methanesulfonic acid; 2-(trimethylammonio)acetate
IUPAC Name:(1,4-dimethyl-1-octylpyrrolidin-1-ium-3-yl)methanesulfonic acid; 2-(trimethylazaniumyl)acetate
Traditional Name:(1,4-dimethyl-1-octyl-pyrrolidin-1-ium-3-yl)methanesulfonic acid; 2-(trimethylammonio)acetate
Formula: C20H43N2O5S+
MolecularWeight: 423.63082
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C15H31NO3S.C5H11NO2/c1-4-5-6-7-8-9-10-16(3)11-14(2)15(12-16)13-20(17,18)19;1-6(2,3)4-5(7)8/h14-15H,4-13H2,1-3H3;4H2,1-3H3/p+1


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