4-azanyl-3-oxidanylidene-2-[1-oxidanyl-2-(trimethylazaniumyl)ethyl]-5-sulfanyl-pentanoate

Systemtic Name: 4-azanyl-3-oxidanylidene-2-[1-oxidanyl-2-(trimethylazaniumyl)ethyl]-5-sulfanyl-pentanoate Openeye Name: 4-amino-2-[1-hydroxy-2-(trimethylammonio)ethyl]-3-oxo-5-sulfanyl-pentanoate CAS Name: 4-amino-2-[1-hydroxy-2-(trimethylammonio)ethyl]-5-mercapto-3-oxopentanoate IUPAC Name: 4-amino-2-[1-hydroxy-2-(trimethylazaniumyl)ethyl]-3-oxo-5-sulfanylpentanoate Traditional Name: 4-amino-2-[1-hydroxy-2-(trimethylammonio)ethyl]-3-keto-5-mercapto-valerate Formula: C10H20N2O4S MolecularWeight: 264.3418

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H20N2O4S/c1-12(2,3)4-7(13)8(10(15)16)9(14)6(11)5-17/h6-8,13H,4-5,11H2,1-3H3,(H-,15,16,17)