(2S)-2-[2-[2-hydroxyethyl(methyl)azaniumyl]ethanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2S)-2-[2-[2-hydroxyethyl(methyl)azaniumyl]ethanoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2S)-2-[[2-[2-hydroxyethyl(methyl)ammonio]acetyl]amino]-4-methylsulfanyl-butanoate CAS Name: (2S)-2-[[2-[2-hydroxyethyl(methyl)ammonio]-1-oxoethyl]amino]-4-(methylthio)butanoate IUPAC Name: (2S)-2-[[2-[2-hydroxyethyl(methyl)azaniumyl]acetyl]amino]-4-methylsulfanylbutanoate Traditional Name: (2S)-2-[[2-[2-hydroxyethyl(methyl)ammonio]acetyl]amino]-4-(methylthio)butyrate Formula: C10H20N2O4S MolecularWeight: 264.3418

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CCO)CC(=O)NC(CCSC)C(=O)[O-]

Isomeric SMILES

C[NH+](CCO)CC(=O)N[C@@H](CCSC)C(=O)[O-]

InChI

InChI=1S/C10H20N2O4S/c1-12(4-5-13)7-9(14)11-8(10(15)16)3-6-17-2/h8,13H,3-7H2,1-2H3,(H,11,14)(H,15,16)/t8-/m0/s1