2-(chloromethylsulfonyl)-2-sulfo-2-(trimethylazaniumyl)ethanoate

Systemtic Name: 2-(chloromethylsulfonyl)-2-sulfo-2-(trimethylazaniumyl)ethanoate Openeye Name: 2-(chloromethylsulfonyl)-2-sulfo-2-(trimethylammonio)acetate CAS Name: 2-(chloromethylsulfonyl)-2-sulfo-2-(trimethylammonio)acetate IUPAC Name: 2-(chloromethylsulfonyl)-2-sulfo-2-(trimethylazaniumyl)acetate Traditional Name: 2-(chloromethylsulfonyl)-2-sulfo-2-(trimethylammonio)acetate Formula: C6H12ClNO7S2 MolecularWeight: 309.74498

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)C(C(=O)[O-])(S(=O)(=O)CCl)S(=O)(=O)O

Isomeric SMILES

C[N+](C)(C)C(C(=O)[O-])(S(=O)(=O)CCl)S(=O)(=O)O

InChI

InChI=1S/C6H12ClNO7S2/c1-8(2,3)6(5(9)10,17(13,14)15)16(11,12)4-7/h4H2,1-3H3,(H-,9,10,13,14,15)