2-[1-(2-azanylethylsulfonyloxy)-2-(trimethylazaniumyl)ethyl]-3-oxidanylidene-hexanoate

Systemtic Name: 2-[1-(2-azanylethylsulfonyloxy)-2-(trimethylazaniumyl)ethyl]-3-oxidanylidene-hexanoate Openeye Name: 2-[1-(2-aminoethylsulfonyloxy)-2-(trimethylammonio)ethyl]-3-oxo-hexanoate CAS Name: 2-[1-(2-aminoethylsulfonyloxy)-2-(trimethylammonio)ethyl]-3-oxohexanoate IUPAC Name: 2-[1-(2-aminoethylsulfonyloxy)-2-(trimethylazaniumyl)ethyl]-3-oxohexanoate Traditional Name: 3-keto-2-[1-tauryloxy-2-(trimethylammonio)ethyl]hexanoate Formula: C13H26N2O6S MolecularWeight: 338.42034

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)C(C(C[N+](C)(C)C)OS(=O)(=O)CCN)C(=O)[O-]

Isomeric SMILES

CCCC(=O)C(C(C[N+](C)(C)C)OS(=O)(=O)CCN)C(=O)[O-]

InChI

InChI=1S/C13H26N2O6S/c1-5-6-10(16)12(13(17)18)11(9-15(2,3)4)21-22(19,20)8-7-14/h11-12H,5-9,14H2,1-4H3