2-(3-azanyl-4-oxidanyl-4-oxidanylidene-butyl)sulfanylethyl-(carboxymethyl)-dimethyl-azanium iodide

Systemtic Name: 2-(3-azanyl-4-oxidanyl-4-oxidanylidene-butyl)sulfanylethyl-(carboxymethyl)-dimethyl-azanium iodide Openeye Name: 2-(3-amino-4-hydroxy-4-oxo-butyl)sulfanylethyl-(carboxymethyl)-dimethyl-ammonium iodide CAS Name: 2-[(3-amino-4-hydroxy-4-oxobutyl)thio]ethyl-(carboxymethyl)-dimethylammonium iodide IUPAC Name: 2-(3-amino-4-hydroxy-4-oxobutyl)sulfanylethyl-(carboxymethyl)-dimethylazanium iodide Traditional Name: 2-[(3-amino-4-hydroxy-4-keto-butyl)thio]ethyl-(carboxymethyl)-dimethyl-ammonium iodide Formula: C10H21IN2O4S MolecularWeight: 392.25421

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H20N2O4S.HI/c1-12(2,7-9(13)14)4-6-17-5-3-8(11)10(15)16;/h8H,3-7,11H2,1-2H3,(H-,13,14,15,16);1H