2-[[(3R)-3-oxidanyl-4-(trimethylazaniumyl)butanoyl]amino]ethanesulfonate

Systemtic Name: 2-[[(3R)-3-oxidanyl-4-(trimethylazaniumyl)butanoyl]amino]ethanesulfonate Openeye Name: 2-[[(3R)-3-hydroxy-4-(trimethylammonio)butanoyl]amino]ethanesulfonate CAS Name: 2-[[(3R)-3-hydroxy-1-oxo-4-(trimethylammonio)butyl]amino]ethanesulfonate IUPAC Name: 2-[[(3R)-3-hydroxy-4-(trimethylazaniumyl)butanoyl]amino]ethanesulfonate Traditional Name: 2-[[(3R)-3-hydroxy-4-(trimethylammonio)butanoyl]amino]ethanesulfonate Formula: C9H20N2O5S MolecularWeight: 268.3305

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)NCCS(=O)(=O)[O-])O

Isomeric SMILES

C[N+](C)(C)C[C@@H](CC(=O)NCCS(=O)(=O)[O-])O

InChI

InChI=1S/C9H20N2O5S/c1-11(2,3)7-8(12)6-9(13)10-4-5-17(14,15)16/h8,12H,4-7H2,1-3H3,(H-,10,13,14,15,16)/t8-/m1/s1