(2S)-2-azaniumyl-3-phenethylsulfanyl-propanoate

Systemtic Name: (2S)-2-azaniumyl-3-phenethylsulfanyl-propanoate Openeye Name: (2S)-2-azaniumyl-3-phenethylsulfanyl-propanoate CAS Name: (2S)-2-ammonio-3-(phenethylthio)propanoate IUPAC Name: (2S)-2-azaniumyl-3-phenethylsulfanylpropanoate Traditional Name: (2S)-2-ammonio-3-(phenethylthio)propionate Formula: C11H15NO2S MolecularWeight: 225.3073

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCSCC(C(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)CCSC[C@H](C(=O)[O-])[NH3+]

InChI

InChI=1S/C11H15NO2S/c12-10(11(13)14)8-15-7-6-9-4-2-1-3-5-9/h1-5,10H,6-8,12H2,(H,13,14)/t10-/m1/s1