(2R)-2-[(2,4-dimethylphenyl)methylsulfanyl]propanoate

Systemtic Name: (2R)-2-[(2,4-dimethylphenyl)methylsulfanyl]propanoate Openeye Name: (2R)-2-[(2,4-dimethylphenyl)methylsulfanyl]propanoate CAS Name: (2R)-2-[(2,4-dimethylphenyl)methylthio]propanoate IUPAC Name: (2R)-2-[(2,4-dimethylphenyl)methylsulfanyl]propanoate Traditional Name: (2R)-2-[(2,4-dimethylbenzyl)thio]propionate Formula: C12H15O2S- MolecularWeight: 223.3113

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)CSC(C)C(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)CS[C@H](C)C(=O)[O-])C

InChI

InChI=1S/C12H16O2S/c1-8-4-5-11(9(2)6-8)7-15-10(3)12(13)14/h4-6,10H,7H2,1-3H3,(H,13,14)/p-1/t10-/m1/s1