2-methylsulfonyl-3-[3-methylsulfonyl-4-oxidanidyl-4-oxidanylidene-1-(trimethylazaniumyl)butan-2-yl]oxy-4-(trimethylazaniumyl)butanoate

Systemtic Name: 2-methylsulfonyl-3-[3-methylsulfonyl-4-oxidanidyl-4-oxidanylidene-1-(trimethylazaniumyl)butan-2-yl]oxy-4-(trimethylazaniumyl)butanoate Openeye Name: 2-methylsulfonyl-3-[2-methylsulfonyl-3-oxido-3-oxo-1-[(trimethylammonio)methyl]propoxy]-4-(trimethylammonio)butanoate CAS Name: 2-methylsulfonyl-3-[3-methylsulfonyl-4-oxido-4-oxo-1-(trimethylammonio)butan-2-yl]oxy-4-(trimethylammonio)butanoate IUPAC Name: 2-methylsulfonyl-3-[3-methylsulfonyl-4-oxido-4-oxo-1-(trimethylazaniumyl)butan-2-yl]oxy-4-(trimethylazaniumyl)butanoate Traditional Name: 3-[3-keto-2-mesyl-3-oxido-1-[(trimethylammonio)methyl]propoxy]-2-mesyl-4-(trimethylammonio)butyrate Formula: C16H32N2O9S2 MolecularWeight: 460.56328

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(C(C(=O)[O-])S(=O)(=O)C)OC(C[N+](C)(C)C)C(C(=O)[O-])S(=O)(=O)C

Isomeric SMILES

C[N+](C)(C)CC(C(C(=O)[O-])S(=O)(=O)C)OC(C[N+](C)(C)C)C(C(=O)[O-])S(=O)(=O)C

InChI

InChI=1S/C16H32N2O9S2/c1-17(2,3)9-11(13(15(19)20)28(7,23)24)27-12(10-18(4,5)6)14(16(21)22)29(8,25)26/h11-14H,9-10H2,1-8H3