(2S)-2-azaniumyl-2-(4-methylsulfanylphenyl)propanoate

Systemtic Name: (2S)-2-azaniumyl-2-(4-methylsulfanylphenyl)propanoate Openeye Name: (2S)-2-azaniumyl-2-(4-methylsulfanylphenyl)propanoate CAS Name: (2S)-2-ammonio-2-[4-(methylthio)phenyl]propanoate IUPAC Name: (2S)-2-azaniumyl-2-(4-methylsulfanylphenyl)propanoate Traditional Name: (2S)-2-ammonio-2-[4-(methylthio)phenyl]propionate Formula: C10H13NO2S MolecularWeight: 211.28072

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C10H13NO2S/c1-10(11,9(12)13)7-3-5-8(14-2)6-4-7/h3-6H,11H2,1-2H3,(H,12,13)/t10-/m0/s1