hexyl (2S)-2-azanyl-3-methyl-3-sulfanyl-butanoate hydrochloride

Systemtic Name: hexyl (2S)-2-azanyl-3-methyl-3-sulfanyl-butanoate hydrochloride Openeye Name: hexyl (2S)-2-amino-3-methyl-3-sulfanyl-butanoate hydrochloride CAS Name: (2S)-2-amino-3-mercapto-3-methylbutanoic acid hexyl ester hydrochloride IUPAC Name: hexyl (2S)-2-amino-3-methyl-3-sulfanylbutanoate hydrochloride Traditional Name: (2S)-2-amino-3-mercapto-3-methyl-butyric acid hexyl ester hydrochloride Formula: C11H24ClNO2S MolecularWeight: 269.83176

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C(C(C)(C)S)N.Cl

Isomeric SMILES

CCCCCCOC(=O)[C@@H](C(C)(C)S)N.Cl

InChI

InChI=1S/C11H23NO2S.ClH/c1-4-5-6-7-8-14-10(13)9(12)11(2,3)15;/h9,15H,4-8,12H2,1-3H3;1H/t9-;/m0./s1