(2R)-2-[3-[ethyl(2-hydroxyethyl)azaniumyl]propanoylamino]-4-methylsulfanyl-butanoate

Systemtic Name: (2R)-2-[3-[ethyl(2-hydroxyethyl)azaniumyl]propanoylamino]-4-methylsulfanyl-butanoate Openeye Name: (2R)-2-[3-[ethyl(2-hydroxyethyl)ammonio]propanoylamino]-4-methylsulfanyl-butanoate CAS Name: (2R)-2-[[3-[ethyl(2-hydroxyethyl)ammonio]-1-oxopropyl]amino]-4-(methylthio)butanoate IUPAC Name: (2R)-2-[3-[ethyl(2-hydroxyethyl)azaniumyl]propanoylamino]-4-methylsulfanylbutanoate Traditional Name: (2R)-2-[3-[ethyl(2-hydroxyethyl)ammonio]propanoylamino]-4-(methylthio)butyrate Formula: C12H24N2O4S MolecularWeight: 292.39496

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H24N2O4S/c1-3-14(7-8-15)6-4-11(16)13-10(12(17)18)5-9-19-2/h10,15H,3-9H2,1-2H3,(H,13,16)(H,17,18)/t10-/m1/s1