(2S)-2-azaniumyl-3-tert-butylsulfanyl-propanoate

Systemtic Name: (2S)-2-azaniumyl-3-tert-butylsulfanyl-propanoate Openeye Name: (2S)-2-azaniumyl-3-tert-butylsulfanyl-propanoate CAS Name: (2S)-2-ammonio-3-(tert-butylthio)propanoate IUPAC Name: (2S)-2-azaniumyl-3-tert-butylsulfanylpropanoate Traditional Name: (2S)-2-ammonio-3-(tert-butylthio)propionate Formula: C7H15NO2S MolecularWeight: 177.2645

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)SCC(C(=O)[O-])[NH3+]

Isomeric SMILES

CC(C)(C)SC[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C7H15NO2S/c1-7(2,3)11-4-5(8)6(9)10/h5H,4,8H2,1-3H3,(H,9,10)/t5-/m1/s1