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

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

Systemtic Name:(1,4-dimethyl-1-tetradecyl-pyrrolidin-1-ium-3-yl)methanesulfonic acid; 2-(trimethylazaniumyl)ethanoate
Openeye Name:(1,4-dimethyl-1-tetradecyl-pyrrolidin-1-ium-3-yl)methanesulfonic acid; 2-(trimethylammonio)acetate
CAS Name:(1,4-dimethyl-1-tetradecyl-3-pyrrolidin-1-iumyl)methanesulfonic acid; 2-(trimethylammonio)acetate
IUPAC Name:(1,4-dimethyl-1-tetradecylpyrrolidin-1-ium-3-yl)methanesulfonic acid; 2-(trimethylazaniumyl)acetate
Traditional Name:(1,4-dimethyl-1-myristyl-pyrrolidin-1-ium-3-yl)methanesulfonic acid; 2-(trimethylammonio)acetate
Formula: C26H55N2O5S+
MolecularWeight: 507.7903
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Descriptors Computed from Structure

Canonical SMILES:

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


Isomeric SMILES

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


InChI

InChI=1S/C21H43NO3S.C5H11NO2/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-22(3)17-20(2)21(18-22)19-26(23,24)25;1-6(2,3)4-5(7)8/h20-21H,4-19H2,1-3H3;4H2,1-3H3/p+1


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