trimethyl-[(2R)-4-oxidanyl-4-oxidanylidene-2-(4-sulfanylbutanoyloxy)butyl]azanium chloride

Systemtic Name: trimethyl-[(2R)-4-oxidanyl-4-oxidanylidene-2-(4-sulfanylbutanoyloxy)butyl]azanium chloride Openeye Name: [(2R)-4-hydroxy-4-oxo-2-(4-sulfanylbutanoyloxy)butyl]-trimethyl-ammonium chloride CAS Name: [(2R)-4-hydroxy-2-(4-mercapto-1-oxobutoxy)-4-oxobutyl]-trimethylammonium chloride IUPAC Name: [(2R)-4-hydroxy-4-oxo-2-(4-sulfanylbutanoyloxy)butyl]-trimethylazanium chloride Traditional Name: [(2R)-4-hydroxy-4-keto-2-(4-mercaptobutanoyloxy)butyl]-trimethyl-ammonium chloride Formula: C11H22ClNO4S MolecularWeight: 299.81468

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(C)CC(CC(=O)O)OC(=O)CCCS.[Cl-]

Isomeric SMILES

C[N+](C)(C)C[C@@H](CC(=O)O)OC(=O)CCCS.[Cl-]

InChI

InChI=1S/C11H21NO4S.ClH/c1-12(2,3)8-9(7-10(13)14)16-11(15)5-4-6-17;/h9H,4-8H2,1-3H3,(H-,13,14,17);1H/t9-;/m1./s1