3-(3-azanyl-4-oxidanyl-4-oxidanylidene-butyl)sulfanylpropyl-(carboxymethyl)-dimethyl-azanium iodide

Systemtic Name: 3-(3-azanyl-4-oxidanyl-4-oxidanylidene-butyl)sulfanylpropyl-(carboxymethyl)-dimethyl-azanium iodide Openeye Name: 3-(3-amino-4-hydroxy-4-oxo-butyl)sulfanylpropyl-(carboxymethyl)-dimethyl-ammonium iodide CAS Name: 3-[(3-amino-4-hydroxy-4-oxobutyl)thio]propyl-(carboxymethyl)-dimethylammonium iodide IUPAC Name: 3-(3-amino-4-hydroxy-4-oxobutyl)sulfanylpropyl-(carboxymethyl)-dimethylazanium iodide Traditional Name: 3-[(3-amino-4-hydroxy-4-keto-butyl)thio]propyl-(carboxymethyl)-dimethyl-ammonium iodide Formula: C11H23IN2O4S MolecularWeight: 406.28079

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Descriptors Computed from Structure

Canonical SMILES:

C[N+](C)(CCCSCCC(C(=O)O)N)CC(=O)O.[I-]

Isomeric SMILES

C[N+](C)(CCCSCCC(C(=O)O)N)CC(=O)O.[I-]

InChI

InChI=1S/C11H22N2O4S.HI/c1-13(2,8-10(14)15)5-3-6-18-7-4-9(12)11(16)17;/h9H,3-8,12H2,1-2H3,(H-,14,15,16,17);1H